file int64 | a float64 | siga float64 | b float64 | sigb float64 | c float64 | sigc float64 | alpha float64 | sigalpha float64 | beta float64 | sigbeta float64 | gamma float64 | siggamma float64 | vol float64 | sigvol float64 | celltemp float64 | sigcelltemp float64 | diffrtemp float64 | sigdiffrtemp float64 | cellpressure float64 | sigcellpressure float64 | diffrpressure float64 | sigdiffrpressure float64 | thermalhist string | pressurehist string | compoundsource string | nel string | sg string | sgHall string | sgNumber int64 | commonname string | chemname string | mineral string | formula string | calcformula string | cellformula string | Z int64 | Zprime float64 | acce_code string | authors string | title string | journal string | year int64 | volume int64 | issue string | firstpage string | lastpage string | doi string | method string | radiation string | wavelength float64 | radType string | radSymbol string | Rall float64 | Robs float64 | Rref float64 | wRall float64 | wRobs float64 | wRref float64 | RFsqd float64 | RI float64 | gofall float64 | gofobs float64 | gofgt float64 | gofref float64 | duplicateof int64 | optimal int64 | status string | flags string | text string | svnrevision int64 | date string | time string | onhold string | cif_text string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,004,113 | 10.989 | 0.004 | 20.086 | 0.003 | 11.058 | 0.003 | 90 | null | 110.5 | 0.3 | 90 | null | 2,286 | 5 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C25 H23 N O5 S - | - C25 H23 N O5 S - | - C100 H92 N4 O20 S4 - | 4 | 1 | CR1183 | Krishnaiah, M.; Jagadeesh Kumar, N.; Bhaskar Reddy, D.; Muralidhar Reddy, M.; Soriano, M.; Chen, Y.-S.; Narasinga Rao, S. | Methyl 6-Benzoyl-3,5-diphenyl-1,4-thiomorpholine-2-carboxylate 1,1-Dioxide | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2426 | 2428 | 10.1107/S010827019500583X | 0.71073 | MoKα | null | 0.056 | null | null | 0.073 | null | null | null | null | 1.46 | 1.46 | null | null | null | has coordinates | Krishnaiah, M.; Jagadeesh Kumar, N.; Bhaskar Reddy, D.; Muralidhar Reddy, M.; Soriano, M.; Chen, Y.-S.; Narasinga Rao, S.
Methyl 6-Benzoyl-3,5-diphenyl-1,4-thiomorpholine-2-carboxylate 1,1-Dioxide
Acta Crystallographica Section C
51(11)
(1995)
2426-2428 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004113.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,114 | 13.049 | 0.001 | 10.411 | 0.001 | 12.317 | 0.003 | 90 | null | 105.5 | 0.1 | 90 | null | 1,612.4 | 0.9 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/a 1 | -P 2yab | 14 | - C16 H24 O5 - | - C16 H24 O5 - | - C64 H96 O20 - | 4 | 1 | CR1184 | Selladurai, S.; Subramanian, K.; Lakshmi, S.; Rajagopalan, K.; Chen, Y. S.; Yang, J.; Narasinga Rao, S. | 5,5-Dimethyl-1,3-dioxacyclohexane-2-spiro(2',γ-dimethyl-3'-oxo-2'-cyclohexaneacrylic Acid) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2424 | 2426 | 10.1107/S0108270195005555 | 0.71073 | MoKα | null | 0.05 | null | null | 0.062 | null | null | null | null | null | null | null | null | null | has coordinates | Selladurai, S.; Subramanian, K.; Lakshmi, S.; Rajagopalan, K.; Chen, Y. S.; Yang, J.; Narasinga Rao, S.
5,5-Dimethyl-1,3-dioxacyclohexane-2-spiro(2',γ-dimethyl-3'-oxo-2'-cyclohexaneacrylic Acid)
Acta Crystallographica Section C
51(11)
(1995)
2424-2426 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004114.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,115 | 17.5076 | 0.0001 | 6.6859 | 0.0001 | 13.0147 | 0.0001 | 90 | null | 94.48 | 0.01 | 90 | null | 1,518.77 | 0.03 | 23 | 1 | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C17 H11 Cl O4 S - | - C17 H11 Cl O4 S - | - C68 H44 Cl4 O16 S4 - | 4 | 1 | CR1186 | Krishnaiah, M.; Narayana Raju, K. V.; Lu, I-L.; Chen, Y.-S.; Narasinga Rao, S. | 3-[2-(4-Chlorophenylsulfonyl)ethenyl]-4<i>H</i>-1-benzopyran-4-one | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2429 | 2430 | 10.1107/S0108270195006597 | 0.71073 | MoKα | null | 0.033 | null | null | 0.05 | null | null | null | null | 1.48 | 1.48 | null | null | null | has coordinates | Krishnaiah, M.; Narayana Raju, K. V.; Lu, I-L.; Chen, Y.-S.; Narasinga Rao, S.
3-[2-(4-Chlorophenylsulfonyl)ethenyl]-4<i>H</i>-1-benzopyran-4-one
Acta Crystallographica Section C
51(11)
(1995)
2429-2430 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004115.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,116 | 7.6922 | 0.0005 | 14.1688 | 0.0008 | 19.3663 | 0.0011 | 90 | null | 90 | null | 90 | null | 2,110.7 | 0.2 | 295 | 2 | 295 | 2 | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | 9α-fluoro-11β-hydroxy-16α-methylandrosta-1,4-diene-3,17-dione 2-butynoate | - C24 H27 F O4 - | - C24 H27 F O4 - | - C96 H108 F4 O16 - | 4 | 1 | CR1188 | Brock, C. P.; Song, J. | 9α-Fluoro-16α-methyl-3,17-dioxoandrosta-1,4-dien-11β-yl 2-Butynoate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2437 | 2439 | 10.1107/S0108270195006020 | 0.71073 | MoKα | 0.0908 | 0.0387 | null | 0.1065 | 0.0897 | null | null | null | 1 | 1.108 | 1.108 | null | null | null | has coordinates | Brock, C. P.; Song, J.
9α-Fluoro-16α-methyl-3,17-dioxoandrosta-1,4-dien-11β-yl 2-Butynoate
Acta Crystallographica Section C
51(11)
(1995)
2437-2439 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004116.cif $
#-------------------------------------------------------------------... | ||||||||||
4,322,317 | 10.938 | null | 10.938 | null | 34.555 | null | 90 | null | 90 | null | 120 | null | 3,580.28 | null | 190 | null | 190 | null | null | null | null | null | 6 | R -3 :H | -R 3 | 148 | - C4 H4 Cl0.67 Fe0.33 N6 O2.67 - | - C12 H12 Cl2 Fe N18 O8 - | - C72 H72 Cl12 Fe6 N108 O48 - | 6 | 0.333333 | Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues | Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate | Inorganic Chemistry | 1,999 | 38 | 4663 | 4670 | 10.1021/ic990511q | 0.71073 | MoKα | null | 0.0382 | null | null | 0.0418 | null | null | null | null | 1.1236 | 1.1236 | null | null | null | has coordinates | Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues
Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate
Inorganic Chemistry
38
(1999)
4663-4670 | 295,997 | 2024-11-19 | 13:15:41 | #------------------------------------------------------------------------------
#$Date: 2024-11-19 15:15:38 +0200 (Tue, 19 Nov 2024) $
#$Revision: 295997 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322317.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,117 | 10.3828 | 0.0007 | 12.2813 | 0.0007 | 10.931 | 0.0009 | 90 | null | 91.207 | 0.006 | 90 | null | 1,393.55 | 0.17 | 295 | 1 | 295 | 1 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 4-phenyl-2,4,6-triazatricyclo[5.4.2.0^2,6^]tridec-12-ene-3,5-dione | - C16 H17 N3 O2 - | - C16 H17 N3 O2 - | - C64 H68 N12 O8 - | 4 | 1 | CR1189 | Brock, C. P.; Demir, A. S.; Watt, D. S. | An Almost Planar Hydrazine Moiety in a Diels–Alder Adduct | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2434 | 2437 | 10.1107/S010827019500624X | 0.71073 | MoKα | 0.1125 | 0.0415 | null | 0.1181 | 0.095 | null | null | null | 1.016 | 1.113 | 1.113 | null | null | null | has coordinates,has disorder | Brock, C. P.; Demir, A. S.; Watt, D. S.
An Almost Planar Hydrazine Moiety in a Diels–Alder Adduct
Acta Crystallographica Section C
51(11)
(1995)
2434-2437 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004117.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,118 | 10.125 | 0.001 | 12.764 | 0.002 | 11.338 | 0.002 | 90 | null | 90.39 | 0.01 | 90 | null | 1,465.2 | 0.4 | 158 | 2 | 158 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 2,4-Dimethyl-9-oxabicyclo[5.3.0]dec-5-en-1,3-diol Deuterochloroform solvate | - C12 H18 Cl3 D O3 - | - C12 H19 Cl3 O3 - | - C48 H76 Cl12 O12 - | 4 | 1 | CR1194 | Kumanovic, S.; Lautens, M.; Lough, A. J. | A Highly Substituted <i>trans</i>-Fused Bicyclo[5.3.0]decene | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2370 | 2372 | 10.1107/S0108270195006573 | 0.71073 | MoKα | 0.0637 | 0.0431 | null | 0.1183 | 0.1051 | null | null | null | 1.019 | 1.054 | 1.054 | null | null | null | has coordinates | Kumanovic, S.; Lautens, M.; Lough, A. J.
A Highly Substituted <i>trans</i>-Fused Bicyclo[5.3.0]decene
Acta Crystallographica Section C
51(11)
(1995)
2370-2372 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004118.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,119 | 11.483 | 0.002 | 11.615 | 0.001 | 12.412 | 0.002 | 90 | null | 111.44 | 0.01 | 90 | null | 1,540.9 | 0.4 | 295 | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | - C16 H24 O3 - | - C16 H24 O3 - | - C64 H96 O12 - | 4 | 1 | DE1006 | Lakshmi, S.; Subramanian, K.; Rajagopalan, K.; Koellner, G.; Steiner, Th. | 1β-Hydroxy-1α-propargyl-2β-methyl-2-(2-ethoxycarbonylvinyl)cycloheptane | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2327 | 2329 | 10.1107/S0108270195005208 | 1.542 | CuKα | null | 0.072 | null | null | 0.072 | null | null | null | null | 0.99 | 0.99 | null | null | null | has coordinates | Lakshmi, S.; Subramanian, K.; Rajagopalan, K.; Koellner, G.; Steiner, Th.
1β-Hydroxy-1α-propargyl-2β-methyl-2-(2-ethoxycarbonylvinyl)cycloheptane
Acta Crystallographica Section C
51(11)
(1995)
2327-2329 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004119.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,120 | 9.1546 | 0.0002 | 9.1546 | 0.0002 | 9.1546 | 0.0002 | 90 | null | 90 | null | 90 | null | 767.22 | 0.05 | 293 | null | null | null | null | null | null | null | 3 | P 21 3 | P 2ac 2ab 3 | 198 | - O8 W2 Zr - | - O8 W2 Zr - | - O32 W8 Zr4 - | 4 | 0.333333 | Auray, Martine; Quarton, Michel; Leblanc, Marc | Zirconium Tungstate | Acta Crystallographica, Section C: Crystal Structure Communications | 1,995 | 51 | 11 | 2210 | 2213 | 10.1107/s0108270195001545 | null | null | null | null | null | null | null | null | null | null | null | null | null | 1,000,396 | null | has coordinates | Auray, Martine; Quarton, Michel; Leblanc, Marc
Zirconium Tungstate
Acta Crystallographica, Section C: Crystal Structure Communications
51(11)
(1995)
2210-2213 | 287,519 | 2023-11-10 | 19:29:21 | #------------------------------------------------------------------------------
#$Date: 2023-11-10 21:21:08 +0200 (Fri, 10 Nov 2023) $
#$Revision: 287519 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004120.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,121 | 13.877 | 0.006 | 10.446 | 0.004 | 8.109 | 0.003 | 79.72 | 0.03 | 97.26 | 0.04 | 93.14 | 0.04 | 1,146.7 | 0.8 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C26 H38 O - | - C26 H38 O - | - C52 H76 O2 - | 2 | 1 | DU1111 | Ginderow, D. | 5-(2,6,6-Triméthyl-2-cyclohexen-1-yl)-3-[2-(2,6,6-triméthyl-2-cyclohexen-1-yl)éthenyl]-2-cyclohexen-1-one | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2455 | 2458 | 10.1107/S0108270195006585 | 1.5418 | CuKα | 0.0766 | 0.0726 | null | 0.1999 | 0.1926 | null | null | null | 1.063 | 1.063 | 1.063 | null | null | null | has coordinates,has disorder | Ginderow, D.
5-(2,6,6-Triméthyl-2-cyclohexen-1-yl)-3-[2-(2,6,6-triméthyl-2-cyclohexen-1-yl)éthenyl]-2-cyclohexen-1-one
Acta Crystallographica Section C
51(11)
(1995)
2455-2458 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004121.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,122 | 45.92 | 0.05 | 10.418 | 0.003 | 7.923 | 0.008 | 90 | null | 92.94 | 0.05 | 90 | null | 3,785 | 6 | 293 | null | null | null | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | 15 | - Cs2 Mo4 O13 - | - Cs2 Mo4 O13 - | - Cs24 Mo48 O156 - | 12 | 1.5 | DU1116 | Marrot, J.; Savariault, J.-M. | Two Original Infinite Chains in the New Caesium Tetramolybdate Compound Cs~2~Mo~4~O~13~ | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2201 | 2205 | 10.1107/S0108270195004811 | 0.71073 | MoKα | null | 0.066 | null | null | 0.16 | null | null | null | null | 1.161 | 1.161 | null | null | null | has coordinates | Marrot, J.; Savariault, J.-M.
Two Original Infinite Chains in the New Caesium Tetramolybdate Compound Cs~2~Mo~4~O~13~
Acta Crystallographica Section C
51(11)
(1995)
2201-2205 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004122.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,123 | 9.368 | 0.002 | 3.396 | 0.001 | 7.799 | 0.003 | 90 | null | 119.42 | 0.01 | 90 | null | 216.12 | 0.12 | 295 | null | null | null | null | null | null | null | 2 | C 1 2/m 1 | -C 2y | 12 | - As2 Nb - | - As2 Nb - | - As8 Nb4 - | 4 | 0.5 | DU1121 | Bensch, W.; Heid, W. | NbAs~2~ | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2205 | 2207 | 10.1107/S0108270195007062 | 0.7107 | MoKα | null | 0.0303 | null | null | 0.0363 | null | null | null | null | 0.9536 | 0.9536 | null | null | null | has coordinates | Bensch, W.; Heid, W.
NbAs~2~
Acta Crystallographica Section C
51(11)
(1995)
2205-2207 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004123.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,124 | 10.6883 | 0.0006 | 18.27 | 0.002 | 10.9819 | 0.0007 | 90 | null | 117.706 | 0.005 | 90 | null | 1,898.6 | 0.3 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/m 1 | -P 2yb | 11 | - C33 H57 Cl O6 Zr - | - C33 H57 Cl O6 Zr - | - C66 H114 Cl2 O12 Zr2 - | 2 | 0.5 | DU1125 | Jardin, M.; Gao, Y.; Guéry, J.; Jacoboni, C. | Chlorotris(2,2,6,6-tetramethyl-3,5-heptanedionato-<i>O</i>,<i>O</i>')zirconium(IV) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2230 | 2232 | 10.1107/S0108270195006494 | 0.71073 | MoKα | null | 0.041 | null | null | 0.041 | null | null | null | null | 1.212 | 1.212 | null | null | null | has coordinates | Jardin, M.; Gao, Y.; Guéry, J.; Jacoboni, C.
Chlorotris(2,2,6,6-tetramethyl-3,5-heptanedionato-<i>O</i>,<i>O</i>')zirconium(IV)
Acta Crystallographica Section C
51(11)
(1995)
2230-2232 | 192,024 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-02-13 17:11:48 +0200 (Mon, 13 Feb 2017) $
#$Revision: 192024 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004124.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,125 | 6.853 | 0.001 | 7.878 | 0.001 | 18.299 | 0.003 | 79.11 | 0.01 | 82.37 | 0.01 | 68.96 | 0.01 | 903.2 | 0.2 | 298 | null | 298 | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | 3,4;3',4'-Bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene Hexafluorophosphate Chloroacetyl chloride solvate | - C11 H9 Cl F3 O0.5 P0.5 S8 - | - C12 H8 Cl F3 O P0.5 S8 - | - C24 H16 Cl2 F6 O2 P S16 - | 2 | 1 | FG1017 | Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R. | Three BEDT-TTF Salts | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2356 | 2362 | 10.1107/S0108270195005592 | 0.71073 | MoKα | 0.0599 | 0.0397 | null | 0.0487 | 0.0455 | null | null | null | null | 1.42 | 1.42 | null | null | null | has coordinates | Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R.
Three BEDT-TTF Salts
Acta Crystallographica Section C
51(11)
(1995)
2356-2362 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004125.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,126 | 8.019 | 0.002 | 9.889 | 0.002 | 12.726 | 0.002 | 80.21 | 0.02 | 85.31 | 0.02 | 81.69 | 0.02 | 982.3 | 0.4 | 298 | null | 298 | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | 3,4;3',4'-Bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene Hexafluorophosphate Tetrahydrofuran solvate | - C12 H12 F6 O0.5 P S8 - | - C17 H22 F6 O P S8 - | - C34 H44 F12 O2 P2 S16 - | 2 | 1 | FG1017 | Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R. | Three BEDT-TTF Salts | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2356 | 2362 | 10.1107/S0108270195005592 | 0.71073 | MoKα | 0.0891 | 0.0453 | null | 0.0638 | 0.0523 | null | null | null | null | 1.57 | 1.57 | null | null | null | has coordinates | Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R.
Three BEDT-TTF Salts
Acta Crystallographica Section C
51(11)
(1995)
2356-2362 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004126.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,127 | 14.172 | 0.002 | 10.63 | 0.002 | 5.751 | 0.001 | 90 | null | 103.78 | 0.01 | 90 | null | 841.4 | 0.2 | 298 | null | 298 | null | null | null | null | null | 5 | C 1 2/m 1 | -C 2y | 12 | 3,4;3',4'-Bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene Perchlorate | - C10 H8 Cl O4 S8 - | - C15 H16 O8 S8 - | - C30 H32 O16 S16 - | 2 | 0.25 | FG1017 | Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R. | Three BEDT-TTF Salts | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2356 | 2362 | 10.1107/S0108270195005592 | 0.71073 | MoKα | 0.0655 | 0.0488 | null | 0.0692 | 0.0644 | null | null | null | null | 2.26 | 2.26 | null | null | null | has coordinates | Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R.
Three BEDT-TTF Salts
Acta Crystallographica Section C
51(11)
(1995)
2356-2362 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004127.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,128 | 8.634 | 0.001 | 8.863 | 0.002 | 11.745 | 0.001 | 90 | null | 98.33 | 0.01 | 90 | null | 889.3 | 0.2 | 294 | null | 294 | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | Dimethyl 9-chloromethyl-9,10-dihydro-9,10-ethenoanthracene- 11,12-dicarboxylate | - C21 H17 Cl O4 - | - C21 H17 Cl O4 - | - C42 H34 Cl2 O8 - | 2 | 1 | FG1072 | Jones, R.; Rettig, S. J.; Trotter, J. | α- and γ-Polymorphs of Dimethyl 9-Chloromethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2392 | 2395 | 10.1107/S0108270195005336 | 1.5418 | CopperKα | null | 0.079 | null | null | 0.088 | null | null | null | null | 4.6 | 4.6 | null | null | null | has coordinates | Jones, R.; Rettig, S. J.; Trotter, J.
α- and γ-Polymorphs of Dimethyl 9-Chloromethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate
Acta Crystallographica Section C
51(11)
(1995)
2392-2395 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004128.cif $
#-------------------------------------------------------------------... | ||||||||||
4,322,316 | 10.971 | null | 10.971 | null | 35.517 | null | 90 | null | 90 | null | 120 | null | 3,702.2 | null | 260 | null | 260 | null | null | null | null | null | 6 | R -3 :H | -R 3 | 148 | - C4 H4 Cl0.67 Fe0.33 N6 O2.67 - | - C12 H12 Cl2 Fe N18 O8 - | - C72 H72 Cl12 Fe6 N108 O48 - | 6 | 0.333333 | Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues | Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate | Inorganic Chemistry | 1,999 | 38 | 4663 | 4670 | 10.1021/ic990511q | 0.71073 | MoKα | null | 0.0401 | null | null | 0.0447 | null | null | null | null | 1.1478 | 1.1478 | null | null | null | has coordinates | Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues
Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate
Inorganic Chemistry
38
(1999)
4663-4670 | 295,997 | 2024-11-19 | 13:15:41 | #------------------------------------------------------------------------------
#$Date: 2024-11-19 15:15:38 +0200 (Tue, 19 Nov 2024) $
#$Revision: 295997 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322316.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,129 | 20.55 | 0.001 | 10.513 | 0.001 | 17.813 | 0.001 | 90 | null | 108.11 | 0.01 | 90 | null | 3,657.7 | 0.5 | 294 | null | 294 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | Dimethyl 9-chloromethyl-9,10-dihydro-9,10-ethenoanthracene- 11,12-dicarboxylate | - C21 H17 Cl O4 - | - C21 H17 Cl O4 - | - C168 H136 Cl8 O32 - | 8 | 2 | FG1072 | Jones, R.; Rettig, S. J.; Trotter, J. | α- and γ-Polymorphs of Dimethyl 9-Chloromethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2392 | 2395 | 10.1107/S0108270195005336 | 1.5418 | CopperKα | null | 0.048 | null | null | 0.056 | null | null | null | null | 4 | 4 | null | null | null | has coordinates | Jones, R.; Rettig, S. J.; Trotter, J.
α- and γ-Polymorphs of Dimethyl 9-Chloromethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate
Acta Crystallographica Section C
51(11)
(1995)
2392-2395 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004129.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,130 | 8.324 | 0.002 | 24.833 | 0.005 | 8.178 | 0.001 | 95.76 | 0.02 | 90.62 | 0.02 | 90.87 | 0.02 | 1,681.6 | 0.6 | 296 | null | 296 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | Dichloro-bis(antazoline)-zinc(II) | - C34 H38 Cl2 N6 Zn - | - C34 H38 Cl2 N6 Zn - | - C68 H76 Cl4 N12 Zn2 - | 2 | 1 | FG1074 | Parvez, M.; Rusiewicz, M. | Bis(antazoline)dichlorozinc(II) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2277 | 2279 | 10.1107/S0108270195006548 | 0.71069 | MoKα | null | 0.061 | null | null | 0.059 | null | null | null | null | 1.99 | 1.99 | null | null | null | has coordinates | Parvez, M.; Rusiewicz, M.
Bis(antazoline)dichlorozinc(II)
Acta Crystallographica Section C
51(11)
(1995)
2277-2279 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004130.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,131 | 7.203 | 0.003 | 34.626 | 0.005 | 7.048 | 0.001 | 90 | null | 90 | null | 90 | null | 1,757.8 | 0.8 | 296 | null | 296 | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | (1S,8S,8aS)-(+)-1-(t-Butyldimethylsilyloxy)-8-hydroxy-5-indolizidinone | - C14 H27 N O3 Si - | - C14 H27 N O3 Si - | - C56 H108 N4 O12 Si4 - | 4 | 1 | FG1075 | Hua, D. H.; Lagneau, N.; Park, J.-G.; Good, L. A.; Robinson, P. D. | (1<i>S</i>,8<i>S</i>,8a<i>S</i>)-(+)-1-(<i>tert</i>-Butyldimethylsilyloxy)-8-hydroxy-1,2,3,5,6,7,8,8a-octahydro-5-indolizinone | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2301 | 2304 | 10.1107/S0108270195004963 | 0.71069 | MoKα | null | 0.054 | null | null | 0.059 | null | null | null | null | 1.8 | 1.8 | null | null | null | has coordinates | Hua, D. H.; Lagneau, N.; Park, J.-G.; Good, L. A.; Robinson, P. D.
(1<i>S</i>,8<i>S</i>,8a<i>S</i>)-(+)-1-(<i>tert</i>-Butyldimethylsilyloxy)-8-hydroxy-1,2,3,5,6,7,8,8a-octahydro-5-indolizinone
Acta Crystallographica Section C
51(11)
(1995)
2301-2304 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004131.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,132 | 5.615 | 0.002 | 10.0655 | 0.001 | 13.0482 | 0.001 | 90 | null | 100.13 | 0.02 | 90 | null | 726 | 0.3 | 293 | 2 | null | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C11 H18 N4 S3 - | - C11 H18 N4 S3 - | - C22 H36 N8 S6 - | 2 | 1 | HU1123 | Billing, D. G.; Boeyens, J. C. A.; Lai, L.-L.; Reid, D. H. | 2,3-Diethyl-5,6,7,8-tetrahydro-2aλ^4^-thia-2,3,4a,8a-tetraazacyclopent[<i>cd</i>]azulene-1(2<i>H</i>),4(3<i>H</i>)-dithione | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2354 | 2356 | 10.1107/S010827019500343X | 0.71069 | MoKα | null | null | null | null | null | null | null | null | null | 0.946 | 0.946 | null | null | null | has coordinates | Billing, D. G.; Boeyens, J. C. A.; Lai, L.-L.; Reid, D. H.
2,3-Diethyl-5,6,7,8-tetrahydro-2aλ^4^-thia-2,3,4a,8a-tetraazacyclopent[<i>cd</i>]azulene-1(2<i>H</i>),4(3<i>H</i>)-dithione
Acta Crystallographica Section C
51(11)
(1995)
2354-2356 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004132.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,133 | 10.711 | 0.004 | 6.115 | 0.003 | 21.514 | 0.004 | 90 | null | 99.919 | 0.02 | 90 | null | 1,388.1 | 0.9 | 120 | null | null | null | null | null | null | null | 2 | P 1 21/c 1 | -P 2ybc | 14 | - C19 H16 - | - C19 H16 - | - C76 H64 - | 4 | 1 | HU1135 | Rajnikant; Watkin, D. J.; Tranter, G. | 4-Benzylbiphenyl | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2388 | 2390 | 10.1107/S0108270195006329 | 0.71069 | MoKα | null | 0.0429 | null | null | 0.051 | null | null | null | null | 0.994 | 0.994 | null | null | null | has coordinates | Rajnikant; Watkin, D. J.; Tranter, G.
4-Benzylbiphenyl
Acta Crystallographica Section C
51(11)
(1995)
2388-2390 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004133.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,134 | 13.363 | 0.003 | 12.802 | 0.002 | 10.828 | 0.002 | 90 | null | 107.04 | 0.02 | 90 | null | 1,771.1 | 0.6 | 293 | 2 | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | - C16 H20 Fe O6 - | - C16 H20 Fe O6 - | - C64 H80 Fe4 O24 - | 4 | 1 | JZ1034 | Solans, X.; Font-Bardia, M. | 3,4-Bis(<i>tert</i>-butoxy)-2,4-cyclopentadien-1-one and its <i>fac</i>-Tricarbonyliron(0) Complex | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2255 | 2258 | 10.1107/S0108270195003039 | 0.71069 | MoKα | null | 0.048 | null | null | 0.124 | null | null | null | null | 0.972 | 0.972 | null | null | null | has coordinates | Solans, X.; Font-Bardia, M.
3,4-Bis(<i>tert</i>-butoxy)-2,4-cyclopentadien-1-one and its <i>fac</i>-Tricarbonyliron(0) Complex
Acta Crystallographica Section C
51(11)
(1995)
2255-2258 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004134.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,135 | 11.679 | 0.003 | 9.741 | 0.002 | 11.74 | 0.003 | 90 | null | 95.5 | 0.03 | 90 | null | 1,329.5 | 0.6 | 293 | 2 | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | - C13 H20 O3 - | - C13 H20 O3 - | - C52 H80 O12 - | 4 | 1 | JZ1034 | Solans, X.; Font-Bardia, M. | 3,4-Bis(<i>tert</i>-butoxy)-2,4-cyclopentadien-1-one and its <i>fac</i>-Tricarbonyliron(0) Complex | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2255 | 2258 | 10.1107/S0108270195003039 | 0.71069 | MoKα | null | 0.052 | null | null | 0.126 | null | null | null | null | 0.93 | 0.93 | null | null | null | has coordinates | Solans, X.; Font-Bardia, M.
3,4-Bis(<i>tert</i>-butoxy)-2,4-cyclopentadien-1-one and its <i>fac</i>-Tricarbonyliron(0) Complex
Acta Crystallographica Section C
51(11)
(1995)
2255-2258 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004135.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,136 | 5.381 | 0.001 | 24.265 | 0.002 | 8.988 | 0.002 | 90 | null | 90.61 | 0.01 | 90 | null | 1,173.5 | 0.4 | 130 | null | null | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C10 H13 N5 O4 - | - C10 H13 N5 O4 - | - C40 H52 N20 O16 - | 4 | 2 | JZ1044 | Schaible, H.-G.; Bats, J. W.; Engels, J. W. | 5'-Azido-2',5'-dideoxythymidine | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2410 | 2412 | 10.1107/S0108270195009310 | 1.54184 | CuKα | null | 0.027 | null | null | 0.081 | null | null | null | null | 2.39 | 2.39 | null | null | null | has coordinates | Schaible, H.-G.; Bats, J. W.; Engels, J. W.
5'-Azido-2',5'-dideoxythymidine
Acta Crystallographica Section C
51(11)
(1995)
2410-2412 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004136.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,137 | 12.551 | 0.002 | 5.0137 | 0.001 | 12.7 | 0.002 | 90 | null | 104.62 | 0.02 | 90 | null | 773.3 | 0.2 | 135 | null | null | null | null | null | null | null | 4 | I 1 2 1 | I 2y | 5 | - C4 H5 K2 O6.5 - | - C4 H5 K2 O6.5 - | - C16 H20 K8 O26 - | 4 | 1 | JZ1050 | Boese, R.; Bläser, D.; Latz, R.; Piennisch, M. | Dipotassium <small>L</small>-Tartrate Semihydrate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2227 | 2229 | 10.1107/S010827019500566X | 0.71069 | MoKα | null | 0.0339 | null | null | 0.0341 | null | null | null | null | 1.0505 | 1.0505 | null | null | null | has coordinates | Boese, R.; Bläser, D.; Latz, R.; Piennisch, M.
Dipotassium <small>L</small>-Tartrate Semihydrate
Acta Crystallographica Section C
51(11)
(1995)
2227-2229 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004137.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,138 | 9.503 | 0.003 | 8.05 | 0.001 | 18.033 | 0.002 | 90 | null | 98.68 | 0.02 | 90 | null | 1,363.7 | 0.5 | 228 | 2 | 228 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | Bis(η^5^-Cyclopentadienyl)zirkonium(2-n-butyl)acetylid Dimer | - C32 H38 Zr2 - | - C32 H38 Zr2 - | - C64 H76 Zr4 - | 2 | 0.5 | JZ1052 | Heshmatpour, F.; Wocadlo, S.; Massa, W.; Dehnicke, K. | Bis(η^5^-Cyclopentadienyl)zirkonium(2-<i>n</i>-butyl)acetylid Dimer | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2225 | 2227 | 10.1107/S0108270195006482 | 0.71073 | MoKα | 0.0495 | 0.0352 | null | 0.086 | 0.082 | null | null | null | 0.907 | 1.018 | 1.018 | null | null | null | has coordinates | Heshmatpour, F.; Wocadlo, S.; Massa, W.; Dehnicke, K.
Bis(η^5^-Cyclopentadienyl)zirkonium(2-<i>n</i>-butyl)acetylid Dimer
Acta Crystallographica Section C
51(11)
(1995)
2225-2227 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004138.cif $
#-------------------------------------------------------------------... | ||||||||||
4,322,315 | 11.03 | null | 11.03 | null | 33.008 | null | 90 | null | 90 | null | 120 | null | 3,477.77 | null | 150 | null | 150 | null | null | null | null | null | 6 | R -3 :H | -R 3 | 148 | - C4 H4 Cl0.67 Fe0.33 N6 O2.67 - | - C12 H12 Cl2 Fe N18 O8 - | - C72 H72 Cl12 Fe6 N108 O48 - | 6 | 0.333333 | Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues | Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate | Inorganic Chemistry | 1,999 | 38 | 4663 | 4670 | 10.1021/ic990511q | 0.71073 | MoKα | null | 0.0719 | null | null | 0.0787 | null | null | null | null | 1.0762 | 1.0762 | null | null | null | has coordinates | Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues
Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate
Inorganic Chemistry
38
(1999)
4663-4670 | 295,997 | 2024-11-19 | 13:15:41 | #------------------------------------------------------------------------------
#$Date: 2024-11-19 15:15:38 +0200 (Tue, 19 Nov 2024) $
#$Revision: 295997 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322315.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,139 | 4.5164 | 0.0005 | 6.1355 | 0.0009 | 18.515 | 0.003 | 90 | null | 94.58 | 0.02 | 90 | null | 511.42 | 0.13 | 293 | null | 293 | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C H6 Fe N O5 P - | - C H6 Fe N O5 P - | - C4 H24 Fe4 N4 O20 P4 - | 4 | 1 | JZ1053 | Cavellec, M.; Riou, D.; Ferey, G. | A Two-Dimensional Iron Phosphate Templated by Ethylenediamine | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2242 | 2244 | 10.1107/S0108270195006731 | 0.71073 | MoKα | 0.0246 | 0.0246 | null | 0.0641 | 0.0641 | null | null | null | 1.072 | 1.072 | 1.072 | null | null | null | has coordinates | Cavellec, M.; Riou, D.; Ferey, G.
A Two-Dimensional Iron Phosphate Templated by Ethylenediamine
Acta Crystallographica Section C
51(11)
(1995)
2242-2244 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004139.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,140 | 10.625 | 0.001 | 12.598 | 0.002 | 13.551 | 0.001 | 101.85 | 0.01 | 112.3 | 0.01 | 90.66 | 0.01 | 1,634.4 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | N,N'[1,1'-dimethylene-3,3'-biisoquinoline 2,2'-dioxide]4,13-diaza-18-crown-6 sodium bromide | - C32 H40 Br N4 Na O7 - | - C32 H40 Br N4 Na O7 - | - C64 H80 Br2 N8 Na2 O14 - | 2 | 1 | KA1105 | Suwinska, K. | Inclusion Complex of <i>N</i>,<i>N</i>'-(1,1'-Dimethylene-3,3'-biisoquinoline 2,2'-dioxide)-4,13-diaza-18-crown-6 with Sodium Bromide | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2232 | 2235 | 10.1107/S0108270195004136 | 1.54178 | CuKα | 0.0379 | 0.0361 | null | 0.1068 | 0.105 | null | null | null | 1.052 | 1.065 | 1.065 | null | null | null | has coordinates | Suwinska, K.
Inclusion Complex of <i>N</i>,<i>N</i>'-(1,1'-Dimethylene-3,3'-biisoquinoline 2,2'-dioxide)-4,13-diaza-18-crown-6 with Sodium Bromide
Acta Crystallographica Section C
51(11)
(1995)
2232-2235 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004140.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,141 | 7.4393 | 0.0008 | 7.6507 | 0.0004 | 15.6806 | 0.0008 | 90 | null | 90 | null | 90 | null | 892.47 | 0.12 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | Ethylenediammonium Tartrate | - C6 H14 N2 O6 - | - C6 H14 N2 O6 - | - C24 H56 N8 O24 - | 4 | 1 | KA1121 | Güneş, B.; Soylu, H.; Akkurt, O.; Özbey, S. | Aminoethylammonium Tartrate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2346 | 2348 | 10.1107/S0108270195006202 | 0.71069 | MoKα | 0.0652 | 0.0618 | null | 0.1706 | 0.1638 | null | null | null | 1.131 | 1.148 | 1.148 | null | null | null | has coordinates | Güneş, B.; Soylu, H.; Akkurt, O.; Özbey, S.
Aminoethylammonium Tartrate
Acta Crystallographica Section C
51(11)
(1995)
2346-2348 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004141.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,142 | 9.211 | 0.004 | 14.671 | 0.004 | 11.533 | 0.004 | 90 | null | 111.14 | 0.04 | 90 | null | 1,453.6 | 1 | 294 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C17 H19 N3 O - | - C17 H19 N3 O - | - C68 H76 N12 O4 - | 4 | 1 | KA1123 | Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K. | 3,3-(Oxydiethyl)-1,2-diphenylguanidine | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2329 | 2331 | 10.1107/S0108270195007645 | 1.54184 | CuKα | null | 0.065 | null | null | 0.065 | null | null | null | null | 1.26 | 1.26 | null | null | null | has coordinates | Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K.
3,3-(Oxydiethyl)-1,2-diphenylguanidine
Acta Crystallographica Section C
51(11)
(1995)
2329-2331 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004142.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,143 | 8.526 | 0.006 | 10.815 | 0.005 | 17.547 | 0.009 | 90 | null | 90.4 | 0.06 | 90 | null | 1,617.9 | 1.6 | 295 | 2 | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | - C16 H24 O3 - | - C16 H24 O3 - | - C64 H96 O12 - | 4 | 1 | KA1125 | Lakshmi, S.; Subramanian, K.; Rajagopalan, K.; Koellner, G.; Steiner, Th. | Alkynyl Contacts in 1β-Hydroxy-1α-propargyl-2α-(2-ethoxycarbonylvinyl)-2,4,4-trimethylcyclopentane | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2325 | 2327 | 10.1107/S0108270195007499 | 1.54184 | CuKα | null | 0.057 | null | null | 0.057 | null | null | null | null | 0.82 | 0.82 | null | null | null | has coordinates | Lakshmi, S.; Subramanian, K.; Rajagopalan, K.; Koellner, G.; Steiner, Th.
Alkynyl Contacts in 1β-Hydroxy-1α-propargyl-2α-(2-ethoxycarbonylvinyl)-2,4,4-trimethylcyclopentane
Acta Crystallographica Section C
51(11)
(1995)
2325-2327 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004143.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,144 | 10.832 | 0.002 | 8.524 | 0.002 | 15.634 | 0.003 | 90 | null | 108.31 | 0.03 | 90 | null | 1,370.4 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 4-(phenylsulfonyl)-1,6-dioxaspiro[4.5]decan-10-one | - C14 H16 O5 S - | - C14 H16 O5 S - | - C56 H64 O20 S4 - | 4 | 1 | KA1126 | Alonso, I.; López-Solera, I.; Raithby, P. R. | 4-Sulfonyl-1,6-dioxaspiro[4.5]decanes | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2381 | 2383 | 10.1107/S0108270195006214 | 0.71073 | MoKα | 0.0942 | 0.0496 | null | 0.1255 | 0.1037 | null | null | null | 1.017 | 1.081 | 1.081 | null | null | null | has coordinates | Alonso, I.; López-Solera, I.; Raithby, P. R.
4-Sulfonyl-1,6-dioxaspiro[4.5]decanes
Acta Crystallographica Section C
51(11)
(1995)
2381-2383 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004144.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,145 | 8.613 | 0.002 | 10.453 | 0.002 | 10.561 | 0.002 | 63.55 | 0.03 | 68.81 | 0.03 | 84.74 | 0.03 | 791 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | 2,7-dimethyl-4-(phenylsulfonyl)-1,6-dioxaspiro[4.5]decan-10-one | - C16 H20 O5 S - | - C16 H20 O5 S - | - C32 H40 O10 S2 - | 2 | 1 | KA1126 | Alonso, I.; López-Solera, I.; Raithby, P. R. | 4-Sulfonyl-1,6-dioxaspiro[4.5]decanes | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2381 | 2383 | 10.1107/S0108270195006214 | 1.54178 | CuKα | 0.046 | 0.0427 | null | 0.1232 | 0.1199 | null | null | null | 1.05 | 1.077 | 1.077 | null | null | null | has coordinates | Alonso, I.; López-Solera, I.; Raithby, P. R.
4-Sulfonyl-1,6-dioxaspiro[4.5]decanes
Acta Crystallographica Section C
51(11)
(1995)
2381-2383 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004145.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,146 | 14.928 | 0.003 | 14.999 | 0.002 | 18.952 | 0.002 | 90 | null | 90 | null | 90 | null | 4,243.4 | 1.1 | 294 | null | null | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | - C22 H26 N4 O2 S - | - C22 H26 N4 O2 S - | - C176 H208 N32 O16 S8 - | 8 | 1 | KA1128 | Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K. | 1-(Morpholinothiocarbonyl)-3,3-(oxydiethyl)-1,2-diphenylguanidine | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2323 | 2325 | 10.1107/S0108270195007165 | 1.54184 | CuKα | null | 0.068 | null | null | 0.073 | null | null | null | null | null | null | null | null | null | has coordinates | Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K.
1-(Morpholinothiocarbonyl)-3,3-(oxydiethyl)-1,2-diphenylguanidine
Acta Crystallographica Section C
51(11)
(1995)
2323-2325 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004146.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,147 | 7.764 | 0.0008 | 13.784 | 0.002 | 15.692 | 0.0015 | 90 | null | 103.77 | 0.008 | 90 | null | 1,631.1 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | none | 2'-Methoxy-5'-methoxycarbonylspiro[dihydroacridine-9(10H),4'-thiazoline] | - C18 H16 N2 O3 S - | - C18 H16 N2 O3 S - | - C72 H64 N8 O12 S4 - | 4 | 1 | KA1131 | Černák, J.; Kristian, P.; Bernát, J.; Lipkowski, J. | 2'-Methoxy-5'-methoxycarbonylspiro[acridine-9(10<i>H</i>),4'(5'<i>H</i>)-thiazole] | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2397 | 2399 | 10.1107/S0108270195006925 | 1.54178 | CuKα | 0.0663 | 0.0538 | null | 0.1628 | 0.1445 | null | null | null | 1.07 | 1.104 | 1.104 | null | null | null | has coordinates | Černák, J.; Kristian, P.; Bernát, J.; Lipkowski, J.
2'-Methoxy-5'-methoxycarbonylspiro[acridine-9(10<i>H</i>),4'(5'<i>H</i>)-thiazole]
Acta Crystallographica Section C
51(11)
(1995)
2397-2399 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004147.cif $
#-------------------------------------------------------------------... | |||||||||
2,004,148 | 7.625 | 0.003 | 11.262 | 0.002 | 13.883 | 0.002 | 90 | null | 90 | null | 90 | null | 1,192.2 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P n a 21 | P 2c -2n | 33 | N-(p-tolyl)phthalimide | - C15 H11 N O2 - | - C15 H11 N O2 - | - C60 H44 N4 O8 - | 4 | 1 | KA1133 | Bocelli, G.; Cantoni, A.; Cozzini, P. | <i>N</i>-(<i>p</i>-Tolyl)phthalimide | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2372 | 2374 | 10.1107/S0108270195007177 | 1.54178 | CuKα | 0.0334 | 0.0304 | null | 0.0806 | 0.0781 | null | null | null | 1.027 | 1.031 | 1.031 | null | null | null | has coordinates | Bocelli, G.; Cantoni, A.; Cozzini, P.
<i>N</i>-(<i>p</i>-Tolyl)phthalimide
Acta Crystallographica Section C
51(11)
(1995)
2372-2374 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004148.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,149 | 7.286 | 0.002 | 7.408 | 0.002 | 30.52 | 0.01 | 90 | null | 90 | null | 90 | null | 1,647.3 | 0.8 | 296 | null | null | null | null | null | null | null | 6 | P b c n | -P 2n 2ab | 60 | - C12 H14 Cd Cl4 N2 O - | - C12 H14 Cd Cl4 N2 O - | - C48 H56 Cd4 Cl16 N8 O4 - | 4 | 0.5 | KH1005 | Huang, X.-Y.; Ye, Q.; Meng, Q.-J.; You, X.-Z. | 4,4'-Oxydianilinium Tetrachlorocadmate(II), an Intercalation Compound | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2285 | 2287 | 10.1107/S0108270195005762 | 0.71069 | MoKα | null | 0.041 | null | null | 0.054 | null | null | null | null | 1.86 | 1.86 | null | null | null | has coordinates | Huang, X.-Y.; Ye, Q.; Meng, Q.-J.; You, X.-Z.
4,4'-Oxydianilinium Tetrachlorocadmate(II), an Intercalation Compound
Acta Crystallographica Section C
51(11)
(1995)
2285-2287 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004149.cif $
#-------------------------------------------------------------------... | |||||||||||
4,322,314 | 5.5362 | 0.0002 | 12.8676 | 0.0005 | 15.4337 | 0.0005 | 90 | null | 99.279 | 0.001 | 90 | null | 1,085.07 | 0.07 | 295 | null | 295 | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C8 H28 Fe2 N2 O16 P4 - | - C8 H28 Fe2 N2 O16 P4 - | - C16 H56 Fe4 N4 O32 P8 - | 2 | 0.5 | Li-Min Zheng; Hui-Hua Song; Chia-Heir Lin; Sue-Lein Wang; Zheng Hu; Zhi Yu; Xin | [NH3(CH2)4NH3]Fe2[CH3C(OH)(PO3)(PO3H)]2.2H2O: A Novel Iron(II) Diphosphonate with a Supramolecular Open Network Structure | Inorganic Chemistry | 1,999 | 38 | 4618 | 4619 | 10.1021/ic990482j | 0.71073 | MoKα | 0.0341 | 0.0254 | null | 0.0697 | 0.0668 | null | null | null | 1.046 | 1.102 | 1.102 | null | null | null | has coordinates | Li-Min Zheng; Hui-Hua Song; Chia-Heir Lin; Sue-Lein Wang; Zheng Hu; Zhi Yu; Xin
[NH3(CH2)4NH3]Fe2[CH3C(OH)(PO3)(PO3H)]2.2H2O: A Novel Iron(II) Diphosphonate with a Supramolecular Open Network Structure
Inorganic Chemistry
38
(1999)
4618-4619 | 179,326 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:24:39 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179326 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322314.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,150 | 14.664 | 0.002 | 13.913 | 0.001 | 17.592 | 0.008 | 90 | null | 102.65 | 0.02 | 90 | null | 3,502 | 1.7 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C30 H23 Cl6 Eu N4 O8 - | - C30 H23 Cl6 Eu N4 O8 - | - C120 H92 Cl24 Eu4 N16 O32 - | 4 | 1 | KH1017 | Lu, W.; Cheng, Y.; Dong, N.; Gu, J.; Xu, C. | Diaquabis(dichloroacetato)bis(1,10-phenanthroline)europium(III) Dichloroacetate and the Corresponding Erbium(III) Complex | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2295 | 2299 | 10.1107/S0108270195004756 | 0.71073 | MoKα | null | 0.043 | null | null | 0.052 | null | null | null | null | 3.556 | 3.556 | null | null | null | has coordinates | Lu, W.; Cheng, Y.; Dong, N.; Gu, J.; Xu, C.
Diaquabis(dichloroacetato)bis(1,10-phenanthroline)europium(III) Dichloroacetate and the Corresponding Erbium(III) Complex
Acta Crystallographica Section C
51(11)
(1995)
2295-2299 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004150.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,151 | 14.564 | 0.002 | 13.879 | 0.002 | 17.505 | 0.008 | 90 | null | 102.36 | 0.02 | 90 | null | 3,456.3 | 1.7 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C30 H23 Cl6 Er N4 O8 - | - C30 H23 Cl6 Er N4 O8 - | - C120 H92 Cl24 Er4 N16 O32 - | 4 | 1 | KH1017 | Lu, W.; Cheng, Y.; Dong, N.; Gu, J.; Xu, C. | Diaquabis(dichloroacetato)bis(1,10-phenanthroline)europium(III) Dichloroacetate and the Corresponding Erbium(III) Complex | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2295 | 2299 | 10.1107/S0108270195004756 | 0.71073 | MoKα | null | 0.054 | null | null | 0.059 | null | null | null | null | 4.785 | 4.785 | null | null | null | has coordinates | Lu, W.; Cheng, Y.; Dong, N.; Gu, J.; Xu, C.
Diaquabis(dichloroacetato)bis(1,10-phenanthroline)europium(III) Dichloroacetate and the Corresponding Erbium(III) Complex
Acta Crystallographica Section C
51(11)
(1995)
2295-2299 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004151.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,152 | 9.632 | 0.001 | 13.094 | 0.001 | 13.226 | 0.001 | 90 | null | 101.65 | 0.01 | 90 | null | 1,633.7 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | 1-(p-Chlorophenyl)-4β(2'-thienyl)-5α-carbomethoxy methyl pyrrolydin-2-one. | - C17 H16 Cl N O3 S - | - C17 H16 Cl N O3 S - | - C68 H64 Cl4 N4 O12 S4 - | 4 | 1 | KH1028 | Sivakumar, K.; Fun, H.-K.; Ray, J. K.; Roy, B. C.; Nigam, G. D. | 1-(<i>p</i>-Chlorophenyl)-5α-methoxycarbonylmethyl-4β-(2-thienyl)pyrrolidin-2-one | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2444 | 2446 | 10.1107/S0108270195006111 | 0.71073 | MoKα | 0.0559 | 0.0424 | null | 0.1266 | 0.1215 | null | null | null | 1.082 | 1.206 | 1.206 | null | null | null | has coordinates | Sivakumar, K.; Fun, H.-K.; Ray, J. K.; Roy, B. C.; Nigam, G. D.
1-(<i>p</i>-Chlorophenyl)-5α-methoxycarbonylmethyl-4β-(2-thienyl)pyrrolidin-2-one
Acta Crystallographica Section C
51(11)
(1995)
2444-2446 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004152.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,153 | 12.119 | 0.001 | 12.984 | 0.001 | 10.335 | 0.001 | 90 | null | 90.67 | 0.01 | 90 | null | 1,626.1 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 1,2,3,4,6,7-hexahydro-10-chloronaphtho[6,7-c]acridine | - C21 H18 Cl N - | - C21 H16.304 Cl N - | - C84 H65.216 Cl4 N4 - | 4 | 1 | KH1029 | Ray, J. K.; Haldar, M.; Nigam, G. D.; Sivakumar, K.; Fun, H.-K. | 1,2,3,4,6,7-Hexahydro-10-chloronaphtho-[3,2-<i>c</i>]acridine | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2441 | 2443 | 10.1107/S0108270195006123 | 0.71073 | MoKα | 0.0676 | 0.0454 | null | 0.1383 | 0.1278 | null | null | null | 0.967 | 1.117 | 1.117 | null | null | null | has coordinates | Ray, J. K.; Haldar, M.; Nigam, G. D.; Sivakumar, K.; Fun, H.-K.
1,2,3,4,6,7-Hexahydro-10-chloronaphtho-[3,2-<i>c</i>]acridine
Acta Crystallographica Section C
51(11)
(1995)
2441-2443 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004153.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,154 | 8.535 | 0.002 | 8.535 | 0.002 | 17.339 | 0.006 | 90 | null | 90 | null | 90 | null | 1,263.1 | 0.6 | 138 | null | null | null | null | null | null | null | 3 | P 41 | P 4w | 76 | - C14 H18 O4 - | - C14 H18 O4 - | - C56 H72 O16 - | 4 | 1 | KH1035 | Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C. | 1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2418 | 2421 | 10.1107/S0108270195007256 | 0.71073 | MoKα | null | 0.036 | null | null | 0.043 | null | null | null | null | null | null | null | null | null | has coordinates | Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C.
1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose
Acta Crystallographica Section C
51(11)
(1... | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004154.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,155 | 6.229 | 0.002 | 11.951 | 0.003 | 18.865 | 0.006 | 90 | null | 90 | null | 90 | null | 1,404.4 | 0.7 | 143 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C16 H19 N O3 - | - C16 H19 N O3 - | - C64 H76 N4 O12 - | 4 | 1 | KH1035 | Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C. | 1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2418 | 2421 | 10.1107/S0108270195007256 | 0.71073 | MoKα | null | 0.041 | null | null | 0.043 | null | null | null | null | null | null | null | null | null | has coordinates | Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C.
1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose
Acta Crystallographica Section C
51(11)
(1... | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004155.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,156 | 18.541 | 0.001 | 8.291 | 0.002 | 15.366 | 0.001 | 90 | null | 97.26 | 0.01 | 90 | null | 2,343.2 | 0.6 | 298 | null | 298 | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | cis-(±)-1,2,3,6,11,11a-Hexahydro-6-methyl-4H-benzo[b]quinolizin-4-one | - C14 H17 N O - | - C14 H17 N O - | - C112 H136 N8 O8 - | 8 | 1 | KH1038 | Beckwith, A. L. J.; Joseph, S. P.; Mayadunne, R. T. A.; Willis, A. C. | <i>cis</i>-(±)-1,2,3,6,11,11a-Hexahydro-6-methyl-4<i>H</i>-benzo[<i>b</i>]quinolizin-4-one | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2307 | 2309 | 10.1107/S0108270195005750 | 1.5418 | CopperKα | 0.067 | 0.047 | null | 0.072 | 0.063 | null | null | null | 1.449 | 1.555 | 1.555 | null | null | null | has coordinates | Beckwith, A. L. J.; Joseph, S. P.; Mayadunne, R. T. A.; Willis, A. C.
<i>cis</i>-(±)-1,2,3,6,11,11a-Hexahydro-6-methyl-4<i>H</i>-benzo[<i>b</i>]quinolizin-4-one
Acta Crystallographica Section C
51(11)
(1995)
2307-2309 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004156.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,157 | 38.48 | 0.01 | 9.046 | 0.002 | 12.344 | 0.001 | 90 | null | 106.08 | 0.03 | 90 | null | 4,128.7 | 1.6 | 300 | null | 300 | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | N-(2-hydroxyphenyl)salicylaldimin | - C13 H11 N O2 - | - C13 H9 N O3 - | - C208 H144 N16 O48 - | 16 | 2 | LI1119 | Elerman, Y.; Elmali, A.; Atakol, O.; Svoboda, I. | <i>N</i>-(2-Hydroxyphenyl)salicylaldimine | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2344 | 2346 | 10.1107/S010827019500388X | 0.71069 | MoKα | null | 0.09 | null | null | 0.09 | null | null | null | null | 1.15 | 1.15 | null | null | null | has coordinates | Elerman, Y.; Elmali, A.; Atakol, O.; Svoboda, I.
<i>N</i>-(2-Hydroxyphenyl)salicylaldimine
Acta Crystallographica Section C
51(11)
(1995)
2344-2346 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004157.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,158 | 4.845 | 0.001 | 5.517 | 0.001 | 23.033 | 0.003 | 90 | null | 93.62 | 0.01 | 90 | null | 614.44 | 0.19 | 296 | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C10 H14 N O5 P - | - C10 H14 N O5 P - | - C20 H28 N2 O10 P2 - | 2 | 1 | MD1002 | Chadha, R. K.; Ösapay, G. | (<i>S</i>)-[1-(Benzyloxycarbonylamino)ethyl]phosphonic Acid | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2340 | 2342 | 10.1107/S0108270195004355 | 1.54178 | CuKα | null | 0.045 | null | null | 0.061 | null | null | null | null | 1.68 | 1.68 | null | null | null | has coordinates | Chadha, R. K.; Ösapay, G.
(<i>S</i>)-[1-(Benzyloxycarbonylamino)ethyl]phosphonic Acid
Acta Crystallographica Section C
51(11)
(1995)
2340-2342 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004158.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,159 | 9.381 | 0.003 | 17.599 | 0.006 | 18.111 | 0.003 | 90 | null | 95.09 | 0.03 | 90 | null | 2,978.3 | 1.5 | 296 | null | null | null | null | null | null | null | 7 | C 1 2/c 1 | -C 2yc | 15 | - C28 H22 F6 N2 Ni O4 S2 - | - C28 H22 F6 N2 Ni O4 S2 - | - C112 H88 F24 N8 Ni4 O16 S8 - | 4 | 0.5 | MU1173 | Xiong, R.-G.; You, X.-Z.; Huang, X.-Y. | Redetermination of <i>cis</i>-Bis(4-methylpyridine)bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-<i>O</i>,<i>O</i>']nickel(II) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2260 | 2261 | 10.1107/S0108270195005877 | 0.71069 | MoKα | null | 0.064 | null | null | 0.074 | null | null | null | null | 1.71 | 1.71 | null | null | null | has coordinates | Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.
Redetermination of <i>cis</i>-Bis(4-methylpyridine)bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-<i>O</i>,<i>O</i>']nickel(II)
Acta Crystallographica Section C
51(11)
(1995)
2260-2261 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004159.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,160 | 8.459 | 0.002 | 9.132 | 0.003 | 9.903 | 0.002 | 95.22 | 0.02 | 84.14 | 0.02 | 104.72 | 0.02 | 734.3 | 0.3 | 296 | null | null | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C20 H34 N2 Ni O4 P2 S4 - | - C20 H34 N2 Ni O4 P2 S4 - | - C20 H34 N2 Ni O4 P2 S4 - | 1 | 0.5 | MU1176 | Song, B.-L.; Xiong, R.-G.; You, X.-Z.; Huang, X.-Y. | <i>trans</i>-Bis(<i>O</i>,<i>O</i>'-diethyl dithiophosphato-<i>S</i>,<i>S</i>')bis(4-methylpyridine)nickel(II) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2258 | 2259 | 10.1107/S0108270195005130 | 0.71073 | MoKα | null | 0.052 | null | null | 0.065 | null | null | null | null | 1.56 | 1.56 | null | null | null | has coordinates | Song, B.-L.; Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.
<i>trans</i>-Bis(<i>O</i>,<i>O</i>'-diethyl dithiophosphato-<i>S</i>,<i>S</i>')bis(4-methylpyridine)nickel(II)
Acta Crystallographica Section C
51(11)
(1995)
2258-2259 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004160.cif $
#-------------------------------------------------------------------... | |||||||||||
4,322,313 | 7.656 | 0.002 | 9.351 | 0.003 | 11.587 | 0.002 | 109.02 | 0.02 | 97.4 | 0.02 | 110.27 | 0.02 | 707.8 | 0.4 | 294 | 2 | 294 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C28 H20 Cu2 N6 O8 S2 - | - C28 H16 Cu2 N6 O7.98 S2 - | - C28 H16 Cu2 N6 O7.98 S2 - | 1 | 0.5 | Isabel Castro; María Luisa Calatayud; Jorunn Sletten; Francesc Lloret; Juan Cano; Miguel Julve; Gunther Seitz; Klaus Mann | Ferro- and Antiferromagnetic Coupling through 1,n-Dithiosquarate Bridges (n= 2, 3) in Copper(II) Dimers. Syntheses, Crystal Structures, and Magnetic Properties of [Cu2(bpca)2(1,2-dtsq)(H2O)].2H2O and [Cu2(bpca)2(1,3-dtsq)].2H2O | Inorganic Chemistry | 1,999 | 38 | 4680 | 4687 | 10.1021/ic9904384 | 0.71073 | MoKα | 0.1271 | 0.09 | null | null | 0.2133 | 0.2381 | null | null | null | null | null | 1.084 | null | null | has coordinates | Isabel Castro; María Luisa Calatayud; Jorunn Sletten; Francesc Lloret; Juan Cano; Miguel Julve; Gunther Seitz; Klaus Mann
Ferro- and Antiferromagnetic Coupling through 1,n-Dithiosquarate Bridges (n= 2, 3) in Copper(II) Dimers. Syntheses, Crystal Structures, and Magnetic Properties of [Cu2(bpca)2(1,2-dtsq)(H2O)].2H2O an... | 179,326 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:24:39 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179326 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322313.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,161 | 17.755 | 0.002 | 5.29 | 0.005 | 17.383 | 0.003 | 90 | null | 121.48 | 0.01 | 90 | null | 1,392.4 | 1.4 | 298 | 2 | null | null | null | null | null | null | 6 | C 1 2 1 | C 2y | 5 | - C24 H30 Cd N4 O10 S2 - | - C24 H30 Cd N4 O10 S2 - | - C48 H60 Cd2 N8 O20 S4 - | 2 | 0.5 | MU1179 | Lusvardi, G.; Menabue, L.; Saladini, M. | Cadmium(II) <i>N</i>-(<i>p</i>-Tolylsulfonyl)glutaminate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2287 | 2289 | 10.1107/S0108270195005385 | 0.71069 | MoKα | null | 0.041 | null | null | 0.038 | null | null | null | null | 0.56 | 0.56 | null | null | null | has coordinates | Lusvardi, G.; Menabue, L.; Saladini, M.
Cadmium(II) <i>N</i>-(<i>p</i>-Tolylsulfonyl)glutaminate
Acta Crystallographica Section C
51(11)
(1995)
2287-2289 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004161.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,162 | 24.4935 | 0.0004 | 24.4935 | 0.0004 | 19.1219 | 0.0006 | 90 | null | 90 | null | 120 | null | 9,934.9 | 0.4 | 298 | null | 298 | null | null | null | null | null | 4 | R -3 :H | -R 3 | 148 | chlorotriphenyltin | chlorotriphenyltin | - C18 H15 Cl Sn - | - C18 H15 Cl Sn - | - C432 H360 Cl24 Sn24 - | 24 | 1.33333 | MU1190 | Ng, S. W. | Rhombohedral Chlorotriphenyltin | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2292 | 2293 | 10.1107/S0108270195006998 | 0.71073 | MoKα | 0.0546 | 0.0344 | null | 0.0871 | 0.0766 | null | null | null | 1.088 | 1.134 | 1.134 | null | null | null | has coordinates | Ng, S. W.
Rhombohedral Chlorotriphenyltin
Acta Crystallographica Section C
51(11)
(1995)
2292-2293 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004162.cif $
#-------------------------------------------------------------------... | |||||||||
2,004,163 | 5.561 | 0.002 | 8.159 | 0.003 | 11.353 | 0.004 | 90 | null | 100.73 | 0.04 | 90 | null | 506.1 | 0.3 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | - C12 H12 N2 - | - C12 H12 N2 - | - C24 H24 N4 - | 2 | 0.5 | NA1166 | Ide, S.; Karacan, N.; Tufan, Y. | 1,2-Bis(4-pyridyl)ethane | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2304 | 2305 | 10.1107/S0108270195005221 | 0.71073 | MoKα | null | 0.035 | null | null | 0.038 | null | null | null | null | 1.2 | 1.2 | null | null | null | has coordinates | Ide, S.; Karacan, N.; Tufan, Y.
1,2-Bis(4-pyridyl)ethane
Acta Crystallographica Section C
51(11)
(1995)
2304-2305 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004163.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,164 | 38.4 | 0.01 | 38.4 | 0.01 | 12.092 | 0.009 | 90 | null | 90 | null | 120 | null | 15,442 | 13 | 80 | 2 | 80 | 2 | null | null | null | null | 7 | R 3 :H | R 3 | 146 | fac-tris(thiocyanato)-tris(triphenylphosphine oxide)iron(III) | - C57 H45 Fe N3 O3 P3 S3 - | - C57 H45 Fe N3 O3 P3 S3 - | - C684 H540 Fe12 N36 O36 P36 S36 - | 12 | 1.33333 | NA1168 | Olejnik, Z.; Lis, T.; Ondrejkovicová, I. | <i>fac</i>-Tris(isothiocyanato)tris(triphenylphosphine oxide)iron(III) at 80 K | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2246 | 2249 | 10.1107/S0108270195006354 | 0.71069 | MoKα | null | 0.0289 | null | null | 0.0759 | null | null | null | null | 1.03 | 1.03 | null | null | null | has coordinates | Olejnik, Z.; Lis, T.; Ondrejkovicová, I.
<i>fac</i>-Tris(isothiocyanato)tris(triphenylphosphine oxide)iron(III) at 80 K
Acta Crystallographica Section C
51(11)
(1995)
2246-2249 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004164.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,165 | 14.806 | 0.002 | 10.677 | 0.002 | 19.669 | 0.005 | 90 | null | 108.55 | 0.02 | 90 | null | 2,947.8 | 1.1 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C24 H27 F12 Fe N7 P2 - | - C24 H27 F12 Fe N7 P2 - | - C96 H108 F48 Fe4 N28 P8 - | 4 | 1 | NA1171 | Boubekeur, K.; Deroche, A.; Lambert, F.; Morgenstern-Badarau, I. | {Tris[4-(2-pyridyl)-3-aza-3-butenyl]amine}iron(II) Bis(hexafluorophosphate), [Fe(py~3~tren)](PF~6~)~2~ | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2244 | 2246 | 10.1107/S010827019500597X | 0.71073 | MoKα | null | 0.051 | null | null | 0.061 | null | null | null | null | 1.854 | 1.854 | null | null | null | has coordinates | Boubekeur, K.; Deroche, A.; Lambert, F.; Morgenstern-Badarau, I.
{Tris[4-(2-pyridyl)-3-aza-3-butenyl]amine}iron(II) Bis(hexafluorophosphate), [Fe(py~3~tren)](PF~6~)~2~
Acta Crystallographica Section C
51(11)
(1995)
2244-2246 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004165.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,166 | 6.967 | 0.001 | 10.346 | 0.002 | 12.877 | 0.003 | 90 | null | 94.12 | 0.03 | 90 | null | 925.8 | 0.3 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C10 H18 Cl4 N6 O2 Sn - | - C10 H18 Cl4 N6 O2 Sn - | - C20 H36 Cl8 N12 O4 Sn2 - | 2 | 0.5 | NA1172 | Casellato, U.; Graziani, R.; Martelli, M.; Plazzogna, G. | Bis(cytosinium) Tetrachlorodimethylstannate(IV) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2293 | 2295 | 10.1107/S0108270195005312 | 0.7107 | MoKα | null | 0.028 | null | null | 0.028 | null | null | null | null | 1.024 | 1.024 | null | null | null | has coordinates | Casellato, U.; Graziani, R.; Martelli, M.; Plazzogna, G.
Bis(cytosinium) Tetrachlorodimethylstannate(IV)
Acta Crystallographica Section C
51(11)
(1995)
2293-2295 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004166.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,167 | 7.75 | 0.004 | 13.131 | 0.006 | 10.912 | 0.003 | 90 | null | 91.22 | 0.03 | 90 | null | 1,110.2 | 0.8 | 173 | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | - C10 H10 Br2 O2 - | - C10 H10 Br2 O2 - | - C40 H40 Br8 O8 - | 4 | 1 | NA1173 | Li, S.; Lundquist, K.; Soubbotin, N.; Stomberg, R. | 2-Bromo-4-[2-bromo-(<i>E</i>)-propylidene]-6-methoxy-2,5-cyclohexadien-1-one | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2366 | 2369 | 10.1107/S0108270195006317 | 0.71073 | MoKα | null | 0.029 | null | null | 0.031 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates,has disorder | Li, S.; Lundquist, K.; Soubbotin, N.; Stomberg, R.
2-Bromo-4-[2-bromo-(<i>E</i>)-propylidene]-6-methoxy-2,5-cyclohexadien-1-one
Acta Crystallographica Section C
51(11)
(1995)
2366-2369 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004167.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,168 | 12.811 | 0.002 | 7.771 | 0.001 | 18.098 | 0.002 | 90 | null | 109.6 | 0.1 | 90 | null | 1,697.3 | 1.1 | 295 | 2 | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | - C10 H16 Cl4 Cu N6 O2 - | - C10 H16 Cl4 Cu N6 O2 - | - C40 H64 Cl16 Cu4 N24 O8 - | 4 | 0.5 | NA1174 | Valle, G.; Ettorre, R.; Peruzzo, V. | Bis(1-methylcytosinium) Tetrachlorocuprate(II) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2273 | 2275 | 10.1107/S0108270195006937 | 0.7107 | MoKα | null | 0.05 | null | null | 0.055 | null | null | null | null | 1.13 | 1.13 | null | null | null | has coordinates | Valle, G.; Ettorre, R.; Peruzzo, V.
Bis(1-methylcytosinium) Tetrachlorocuprate(II)
Acta Crystallographica Section C
51(11)
(1995)
2273-2275 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004168.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,169 | 13.529 | 0.008 | 14.323 | 0.008 | 8.447 | 0.004 | 90 | null | 91.93 | 0.02 | 90 | null | 1,635.9 | 1.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | II | 4,6-Dimethoxy-3-methyl-dihydrotriazine-2-one | - C6 H9 N3 O3 - | - C6 H9 N3 O3 - | - C48 H72 N24 O24 - | 8 | 2 | NA1180 | Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M. | 4,6-Dimethoxy-3-methyl-1,3,5-triazin-2(3<i>H</i>)-one and 6-Methoxy-3,5-dimethyl-1,3,5-triazine-2,4(3<i>H</i>,5<i>H</i>)-dione | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2421 | 2424 | 10.1107/S0108270195007220 | 0.71069 | MoKα | 0.1125 | 0.067 | null | 0.1853 | 0.16 | null | null | null | 1.064 | 1.232 | 1.232 | null | null | null | has coordinates | Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M.
4,6-Dimethoxy-3-methyl-1,3,5-triazin-2(3<i>H</i>)-one and 6-Methoxy-3,5-dimethyl-1,3,5-triazine-2,4(3<i>H</i>,5<i>H</i>)-dione
Acta Crystallographica Section C
51(11)
(1995)
2421-2424 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004169.cif $
#-------------------------------------------------------------------... | |||||||||
2,004,170 | 8.362 | 0.004 | 14.356 | 0.008 | 7.168 | 0.004 | 90 | null | 114.41 | 0.02 | 90 | null | 783.6 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | III | 6-Methoxy-3,5-dimethyl-tetrahydrotriazine-2,4,-dione | - C6 H9 N3 O3 - | - C6 H9 N3 O3 - | - C24 H36 N12 O12 - | 4 | 1 | NA1180 | Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M. | 4,6-Dimethoxy-3-methyl-1,3,5-triazin-2(3<i>H</i>)-one and 6-Methoxy-3,5-dimethyl-1,3,5-triazine-2,4(3<i>H</i>,5<i>H</i>)-dione | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2421 | 2424 | 10.1107/S0108270195007220 | 0.71069 | MoKα | 0.1071 | 0.078 | null | 0.1986 | 0.167 | null | null | null | 1.13 | 1.241 | 1.241 | null | null | null | has coordinates | Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M.
4,6-Dimethoxy-3-methyl-1,3,5-triazin-2(3<i>H</i>)-one and 6-Methoxy-3,5-dimethyl-1,3,5-triazine-2,4(3<i>H</i>,5<i>H</i>)-dione
Acta Crystallographica Section C
51(11)
(1995)
2421-2424 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004170.cif $
#-------------------------------------------------------------------... | |||||||||
2,004,171 | 6.908 | 0.006 | 9.662 | 0.001 | 14.012 | 0.002 | 84.53 | 0.01 | 74.5 | 0.03 | 86.98 | 0.03 | 896.8 | 0.8 | 295 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C14 H18 N8 O7 - | - C14 H18 N8 O7 - | - C28 H36 N16 O14 - | 2 | 1 | NS1005 | Gallardo, H.; Meyer, E.; Vencato, I. | 5-(2,4-Dihydroxyphenyl)tetrazole Sesquihydrate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2430 | 2432 | 10.1107/S0108270195007505 | 0.7107 | Mo | null | 0.0468 | null | null | 0.06 | null | null | null | null | 0.75 | 0.75 | null | null | null | has coordinates | Gallardo, H.; Meyer, E.; Vencato, I.
5-(2,4-Dihydroxyphenyl)tetrazole Sesquihydrate
Acta Crystallographica Section C
51(11)
(1995)
2430-2432 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004171.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,172 | 10.427 | 0.001 | 7.197 | 0.001 | 11.805 | 0.001 | 90 | null | 99.755 | 0.008 | 90 | null | 873.08 | 0.17 | 296 | null | null | null | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | - C16 H21 N7 - | - C16 H21 N7 - | - C32 H42 N14 - | 2 | 1 | OH1073 | Saito, H.; Eda, M.; Sugio, S.; Ueda, Y. | Chiral <i>N</i>-(6-Amino-3-pyridyl)-<i>N</i>'-bicycloalkyl-<i>N</i>''-cyanoguanidine Derivative: a Novel Potassium-Channel Opener | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2331 | 2333 | 10.1107/S010827019500031X | 1.5418 | CuKα | null | 0.045 | null | null | 0.071 | null | null | null | null | 1.45 | 1.45 | null | null | null | has coordinates | Saito, H.; Eda, M.; Sugio, S.; Ueda, Y.
Chiral <i>N</i>-(6-Amino-3-pyridyl)-<i>N</i>'-bicycloalkyl-<i>N</i>''-cyanoguanidine Derivative: a Novel Potassium-Channel Opener
Acta Crystallographica Section C
51(11)
(1995)
2331-2333 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004172.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,173 | 11.4603 | 0.0002 | 11.4603 | 0.0002 | 11.4603 | 0.0002 | 90 | null | 90 | null | 90 | null | 1,505.18 | 0.05 | 298 | null | null | null | null | null | null | null | 4 | I a -3 d | null | - Al2 Co3 O12 Si3 - | - Al2 Co3 O12 Si3 - | - Al16 Co24 O96 Si24 - | 8 | 0.083333 | OH1074 | Ohashi, H.; Osawa, T.; Sato, A. | Low-Pressure Polymorph of Co~3~Al~2~Si~3~O~12~ | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2213 | 2215 | 10.1107/S0108270195004719 | 0.71073 | MoKα | null | 0.021 | null | null | 0.03 | null | null | null | null | 1.014 | 1.014 | null | null | null | has coordinates | Ohashi, H.; Osawa, T.; Sato, A.
Low-Pressure Polymorph of Co~3~Al~2~Si~3~O~12~
Acta Crystallographica Section C
51(11)
(1995)
2213-2215 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004173.cif $
#-------------------------------------------------------------------... | ||||||||||||
2,004,174 | 10.494 | 0.001 | 10.494 | 0.001 | 8.939 | 0.002 | 90 | null | 90 | null | 90 | null | 984.4 | 0.3 | 296 | null | null | null | null | null | null | null | 4 | I -4 2 d | I -4 2bw | 122 | - B6 Cs Li O10 - | - B6 Cs Li O10 - | - B24 Cs4 Li4 O40 - | 4 | 0.25 | OH1076 | Sasaki, T.; Mori, Y.; Kuroda, I.; Nakajima, S.; Yamaguchi, K.; Watanabe, S.; Nakai, S. | Caesium Lithium Borate: a New Nonlinear Optical Crystal | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2222 | 2224 | 10.1107/S0108270195005798 | 0.71073 | MoKα | null | 0.023 | null | null | 0.035 | null | null | null | null | 2.37 | 2.37 | null | null | null | has coordinates | Sasaki, T.; Mori, Y.; Kuroda, I.; Nakajima, S.; Yamaguchi, K.; Watanabe, S.; Nakai, S.
Caesium Lithium Borate: a New Nonlinear Optical Crystal
Acta Crystallographica Section C
51(11)
(1995)
2222-2224 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004174.cif $
#-------------------------------------------------------------------... | |||||||||||
4,322,312 | 9.3243 | 0.0004 | 10.9036 | 0.0005 | 15.5432 | 0.0004 | 90.276 | 0.002 | 100.009 | 0.002 | 94.139 | 0.002 | 1,551.9 | 0.11 | 223 | 2 | 223 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C28 H22 Cu2 N6 O9 S2 - | - C28 H16 Cu2 N6 O9 S2 - | - C56 H32 Cu4 N12 O18 S4 - | 2 | 1 | Isabel Castro; María Luisa Calatayud; Jorunn Sletten; Francesc Lloret; Juan Cano; Miguel Julve; Gunther Seitz; Klaus Mann | Ferro- and Antiferromagnetic Coupling through 1,n-Dithiosquarate Bridges (n= 2, 3) in Copper(II) Dimers. Syntheses, Crystal Structures, and Magnetic Properties of [Cu2(bpca)2(1,2-dtsq)(H2O)].2H2O and [Cu2(bpca)2(1,3-dtsq)].2H2O | Inorganic Chemistry | 1,999 | 38 | 4680 | 4687 | 10.1021/ic9904384 | 0.71073 | MoKα | 0.1062 | 0.0662 | null | 0.1854 | 0.1612 | null | null | null | 1.014 | 1.106 | 1.106 | null | null | null | has coordinates | Isabel Castro; María Luisa Calatayud; Jorunn Sletten; Francesc Lloret; Juan Cano; Miguel Julve; Gunther Seitz; Klaus Mann
Ferro- and Antiferromagnetic Coupling through 1,n-Dithiosquarate Bridges (n= 2, 3) in Copper(II) Dimers. Syntheses, Crystal Structures, and Magnetic Properties of [Cu2(bpca)2(1,2-dtsq)(H2O)].2H2O an... | 179,326 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:24:39 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179326 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322312.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,004,175 | 5.23 | 0.003 | 6.822 | 0.001 | 5.175 | 0.002 | 91.54 | 0.02 | 117.51 | 0.03 | 90.46 | 0.03 | 163.66 | 0.12 | 293 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | magnesium sodium monophosphate | - H Mg Na3 O8 P2 - | - H Mg Na3 O8 P2 - | - H Mg Na3 O8 P2 - | 1 | 0.5 | OH1084 | Kawahara, A.; Yamakawa, J.; Yamada, T.; Kobashi, D. | Synthetic Magnesium Sodium Hydrogen Monophosphate: MgNa~3~H(PO~4~)~2~ | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2220 | 2222 | 10.1107/S0108270195006901 | 0.71069 | MoKα | null | 0.026 | null | null | 0.033 | null | null | null | null | 2.34 | 2.34 | null | null | null | has coordinates | Kawahara, A.; Yamakawa, J.; Yamada, T.; Kobashi, D.
Synthetic Magnesium Sodium Hydrogen Monophosphate: MgNa~3~H(PO~4~)~2~
Acta Crystallographica Section C
51(11)
(1995)
2220-2222 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004175.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,176 | 7.181 | 0.002 | 8.485 | 0.003 | 11.446 | 0.003 | 90 | null | 103.11 | 0.02 | 90 | null | 679.2 | 0.4 | 298 | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C13 H17 Br N2 O - | - C13 H17 Br N2 O - | - C26 H34 Br2 N4 O2 - | 2 | 1 | PA1181 | Belin, C.; Chauvet, A.; Leloup, J. M.; Ribet, J. P.; Maurel, J. L. | 2-[2-(2-Ethyl-2,3-dihydrobenzofuranyl)]-2-imidazoline Hydrobromide | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2439 | 2441 | 10.1107/S0108270195006706 | 0.7107 | MoKα | null | 0.0391 | null | null | 0.0494 | null | null | null | null | 0.87 | 0.87 | null | null | null | has coordinates | Belin, C.; Chauvet, A.; Leloup, J. M.; Ribet, J. P.; Maurel, J. L.
2-[2-(2-Ethyl-2,3-dihydrobenzofuranyl)]-2-imidazoline Hydrobromide
Acta Crystallographica Section C
51(11)
(1995)
2439-2441 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004176.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,177 | 9.61 | 0.003 | 11.468 | 0.003 | 9.043 | 0.002 | 109.26 | 0.03 | 98.36 | 0.02 | 73.59 | 0.03 | 901 | 0.5 | 295 | 2 | 295 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C17 H22 O8 - | - C17 H22 O8 - | - C34 H44 O16 - | 2 | 1 | PA1182 | Bocelli, G.; Cantoni, A.; Costa, M. | Dimethyl 4,4-Bis(ethoxycarbonyl)-1,2-cyclopentanediylidenediacetate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2374 | 2376 | 10.1107/S010827019500669X | 0.71069 | MoKα | 0.1558 | 0.0436 | null | 0.1071 | 0.0947 | null | null | null | 0.7 | 1.091 | 1.091 | null | null | null | has coordinates | Bocelli, G.; Cantoni, A.; Costa, M.
Dimethyl 4,4-Bis(ethoxycarbonyl)-1,2-cyclopentanediylidenediacetate
Acta Crystallographica Section C
51(11)
(1995)
2374-2376 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004177.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,178 | 21.184 | 0.005 | 21.184 | 0.005 | 15.412 | 0.004 | 90 | null | 90 | null | 90 | null | 6,916 | 3 | 291 | 2 | 293 | null | null | null | null | null | 5 | I 41/a :2 | -I 4ad | 88 | - C16 H12 Cl N O3 - | - C16 H12 Cl N O3 - | - C256 H192 Cl16 N16 O48 - | 16 | 1 | PA1184 | Palmer, R. A.; Richards, A. J.; Lisgarten, J. N. | 2-Benzamido-3-(<i>p</i>-chlorophenyl)propenoic Acid (Antrex) | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2338 | 2340 | 10.1107/S010827019500672X | 1.54178 | CuKα | 0.1133 | 0.0695 | null | 0.3261 | 0.1838 | null | null | null | 1.07 | 1.128 | 1.128 | null | null | null | has coordinates | Palmer, R. A.; Richards, A. J.; Lisgarten, J. N.
2-Benzamido-3-(<i>p</i>-chlorophenyl)propenoic Acid (Antrex)
Acta Crystallographica Section C
51(11)
(1995)
2338-2340 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004178.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,179 | 7.9184 | 0.001 | 8.9446 | 0.0014 | 10.861 | 0.002 | 109.41 | 0.009 | 107.918 | 0.006 | 90.336 | 0.006 | 685.31 | 0.19 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | 2,4,7-Trimethyl-2,3-dihydro-4H-pyrido[4,3-e]-1,2,4-thiadiazinium 1,1-Dioxide Iodide | - C9 H14 I N3 O2 S - | - C9 H14 I N3 O2 S - | - C18 H28 I2 N6 O4 S2 - | 2 | 1 | PA1187 | Dupont, L.; Pirotte, B.; de Tullio, P.; Diouf, O.; Masereel, B.; Delarge, J. | 2,4,7-Trimethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazinium 1,1-Dioxide Iodide | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2412 | 2414 | 10.1107/S0108270195008006 | 1.5418 | CuKα | 0.0743 | 0.0692 | null | 0.2008 | 0.1896 | null | null | null | 1.072 | 1.091 | 1.091 | null | null | null | has coordinates | Dupont, L.; Pirotte, B.; de Tullio, P.; Diouf, O.; Masereel, B.; Delarge, J.
2,4,7-Trimethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazinium 1,1-Dioxide Iodide
Acta Crystallographica Section C
51(11)
(1995)
2412-2414 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004179.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,180 | 12.641 | 0.002 | 5.5304 | 0.001 | 13.615 | 0.003 | 90 | null | 105.847 | 0.015 | 90 | null | 915.6 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | 14 | 3,7-Dimethyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide inner salt | - C8 H9 N3 O2 S - | - C8 H9 N3 O2 S - | - C32 H36 N12 O8 S4 - | 4 | 1 | PA1192 | Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J. | 3,7-Dimethyl-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide Zwitterion | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2414 | 2416 | 10.1107/S010827019500802X | 1.5418 | CuKα | 0.0636 | 0.0454 | null | 0.1281 | 0.1208 | null | null | null | 0.948 | 1.063 | 1.063 | null | null | null | has coordinates,has Fobs | Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J.
3,7-Dimethyl-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide Zwitterion
Acta Crystallographica Section C
51(11)
(1995)
2414-2416 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004180.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,181 | 7.3767 | 0.0007 | 8.1696 | 0.0007 | 8.5483 | 0.0007 | 82.557 | 0.009 | 83.195 | 0.007 | 84.162 | 0.005 | 505.27 | 0.08 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | 7-Methyl-3-methylsulfanyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-Dioxide Inner Salt | - C8 H9 N3 O2 S2 - | - C8 H9 N3 O2 S2 - | - C16 H18 N6 O4 S4 - | 2 | 1 | PA1194 | Dupont, L.; de Tullio, P.; Pirotte, B.; Masereel, B.; Delarge, J. | 7-Methyl-3-methylthio-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazin-7-ium-4-ide 1,1-Dioxide Zwitterion | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2416 | 2417 | 10.1107/S0108270195008031 | 1.5418 | CuKα | 0.0447 | 0.042 | null | 0.1297 | 0.1145 | null | null | null | 1.051 | 1.084 | 1.084 | null | null | null | has coordinates | Dupont, L.; de Tullio, P.; Pirotte, B.; Masereel, B.; Delarge, J.
7-Methyl-3-methylthio-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazin-7-ium-4-ide 1,1-Dioxide Zwitterion
Acta Crystallographica Section C
51(11)
(1995)
2416-2417 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004181.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,182 | 11.742 | 0.003 | 9.1 | 0.002 | 15.705 | 0.003 | 90 | null | 90 | null | 90 | null | 1,678.1 | 0.7 | 297 | null | null | null | null | null | null | null | 3 | P b c a | -P 2ac 2ab | 61 | - C8 H12 O3 - | - C8 H11 O3 - | - C64 H88 O24 - | 8 | 1 | PT1006 | Coté, M. L.; Lalancette, R. A.; Thompson, H. W. | (±)-2-Oxocyclohexaneacetic Acid: Structure and Hydrogen-Bonding Pattern of a γ-Keto Acid | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2305 | 2307 | 10.1107/S0108270195006640 | 0.71073 | MoKα | null | 0.0446 | null | null | 0.0529 | null | null | null | null | 1.1 | 1.1 | null | null | null | has coordinates | Coté, M. L.; Lalancette, R. A.; Thompson, H. W.
(±)-2-Oxocyclohexaneacetic Acid: Structure and Hydrogen-Bonding Pattern of a γ-Keto Acid
Acta Crystallographica Section C
51(11)
(1995)
2305-2307 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004182.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,183 | 4.463 | 0.003 | 11.546 | 0.005 | 15.697 | 0.005 | 90 | null | 95.75 | 0.05 | 90 | null | 804.8 | 0.7 | 150 | 0.2 | 150 | 0.2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 3-acetoxymethylpyrrole-2-carbaldehyde | - C8 H9 N O3 - | - C8 H9 N O3 - | - C32 H36 N4 O12 - | 4 | 1 | PT1024 | Blake, A. J.; McNab, H.; Parsons, S.; Thornley, C. | 3-Acetoxymethylpyrrole-2-carbaldehyde | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2348 | 2350 | 10.1107/S0108270195006238 | 0.71073 | MoKα | 0.0873 | 0.0538 | null | 0.1703 | 0.1244 | null | null | null | 1.045 | 0.983 | 0.983 | null | null | null | has coordinates,has Fobs | Blake, A. J.; McNab, H.; Parsons, S.; Thornley, C.
3-Acetoxymethylpyrrole-2-carbaldehyde
Acta Crystallographica Section C
51(11)
(1995)
2348-2350 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004183.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,184 | 7.5018 | 0.001 | 17.358 | 0.004 | 5.6204 | 0.0004 | 90 | null | 90 | null | 90 | null | 731.9 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | A b m 2 | A 2 -2b | 39 | - S1.68 Se0.32 Ta3 - | - S1.673 Se0.327 Ta3 - | - S13.384 Se2.616 Ta24 - | 8 | null | SE1065 | Degen, T.; Harbrecht, B. | Ta~3~S~2{-~<i>x</i>}Se~<i>x~</i>, Partial Substitution of Selenium for Sulfur into a Tantalum-Rich Sulfide | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2218 | 2220 | 10.1107/S0108270194009923 | 0.7093 | MoKα | 0.0439 | 0.0222 | null | 0.0425 | 0.0397 | null | null | null | 0.916 | 0.97 | 0.97 | null | null | null | has coordinates | Degen, T.; Harbrecht, B.
Ta~3~S~2{-~<i>x</i>}Se~<i>x~</i>, Partial Substitution of Selenium for Sulfur into a Tantalum-Rich Sulfide
Acta Crystallographica Section C
51(11)
(1995)
2218-2220 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004184.cif $
#-------------------------------------------------------------------... | |||||||||||
4,322,311 | 15.38 | 0.005 | 15.38 | 0.005 | 15.38 | 0.005 | 90 | null | 90 | null | 90 | null | 3,638 | 2 | 295 | null | 295 | null | null | null | null | null | ? | 7 | P 21 3 | P 2ac 2ab 3 | 198 | - C36 H26 Cr Li N6 Ni O13 - | - C36 H24 Cr Li N6 Ni O13 - | - C144 H96 Cr4 Li4 N24 Ni4 O52 - | 4 | 0.333333 | Román Andrés; Michel Gruselle; Bernard Malézieux; Michel Verdaguer; Jacqueline Vaissermann | Enantioselective Synthesis of Optically Active Polymeric Homo- and Bimetallic Oxalate-Bridged Networks [M2(ox)3]n | Inorganic Chemistry | 1,999 | 38 | 4637 | 4646 | 10.1021/ic9904135 | 0.71069 | MoKα | null | 0.0476 | null | null | 0.0578 | null | null | null | null | 0.9549 | 0.9549 | null | null | null | has coordinates | Román Andrés; Michel Gruselle; Bernard Malézieux; Michel Verdaguer; Jacqueline Vaissermann
Enantioselective Synthesis of Optically Active Polymeric Homo- and Bimetallic Oxalate-Bridged Networks [M2(ox)3]n
Inorganic Chemistry
38
(1999)
4637-4646 | 211,332 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-10-05 15:19:55 +0300 (Fri, 05 Oct 2018) $
#$Revision: 211332 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322311.cif $
#-------------------------------------------------------------------... | ||||||||||||
2,004,185 | 13.719 | 0.002 | 7.726 | 0.001 | 3.875 | 0.001 | 90 | null | 95.5 | 0.02 | 90 | null | 408.83 | 0.13 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | sym-Tricyanobenzene | 1,3,5-Tricyanobenzene | - C9 H3 N3 - | - C9 H3 N3 - | - C18 H6 N6 - | 2 | 1 | SE1078 | Reddy, D. S.; Panneerselvam, K.; Desiraju, G. R.; Carrell, H. L.; Carrell, C. J. | 1,3,5-Tricyanobenzene | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2352 | 2354 | 10.1107/S0108270195004483 | 0.7107 | MoKα | 0.052 | 0.0428 | null | 0.1328 | 0.1149 | null | null | null | 0.628 | 0.611 | 0.611 | null | null | null | has coordinates | Reddy, D. S.; Panneerselvam, K.; Desiraju, G. R.; Carrell, H. L.; Carrell, C. J.
1,3,5-Tricyanobenzene
Acta Crystallographica Section C
51(11)
(1995)
2352-2354 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004185.cif $
#-------------------------------------------------------------------... | |||||||||
2,004,186 | 8.575 | 0.002 | 20.711 | 0.004 | 16.583 | 0.003 | 90 | null | 99.91 | 0.02 | 90 | null | 2,901.1 | 1 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C26 H44 N2 Ni O P2 - | - C26 H44 N2 Ni O P2 - | - C104 H176 N8 Ni4 O4 P8 - | 4 | 1 | SZ1022 | Penney, J.; VanderLende, D. D.; Boncella, J. M.; Abboud, K. A. | <i>trans</i>-Ni(Mes)[N(Ph)C(O)N(H)CMe~3~](PMe~3~)~2~ | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2269 | 2271 | 10.1107/S0108270195004513 | 0.71073 | MoKα | null | 0.0571 | null | null | 0.0627 | null | null | null | null | 1.7 | 1.7 | null | null | null | has coordinates | Penney, J.; VanderLende, D. D.; Boncella, J. M.; Abboud, K. A.
<i>trans</i>-Ni(Mes)[N(Ph)C(O)N(H)CMe~3~](PMe~3~)~2~
Acta Crystallographica Section C
51(11)
(1995)
2269-2271 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004186.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,187 | 6.336 | 0.004 | 7.986 | 0.005 | 17.602 | 0.009 | 90 | null | 92.88 | 0.06 | 90 | null | 889.5 | 0.9 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 4,4'-dinitro-2,2'-biimidazole | - C12 H18 N8 O6 - | - C12 H18 N8 O6 - | - C24 H36 N16 O12 - | 2 | 0.5 | SZ1034 | Bryan, C. D.; Scott, S.; Cordes, A. W.; Folkert, S. L.; Hester, C.; Collier, H. | 4,4'-Dinitro-2,2'-biimidazole Dimethylformamide Solvate | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2300 | 2301 | 10.1107/S0108270195004525 | 0.7107 | MoKα | 0.14 | 0.051 | null | 0.087 | 0.067 | null | null | null | null | 1.07 | 1.07 | null | null | null | has coordinates | Bryan, C. D.; Scott, S.; Cordes, A. W.; Folkert, S. L.; Hester, C.; Collier, H.
4,4'-Dinitro-2,2'-biimidazole Dimethylformamide Solvate
Acta Crystallographica Section C
51(11)
(1995)
2300-2301 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004187.cif $
#-------------------------------------------------------------------... | ||||||||||
2,004,188 | 17.833 | 0.003 | 17.833 | 0.003 | 8.543 | 0.001 | 90 | null | 90 | null | 120 | null | 2,352.8 | 0.6 | 296 | null | null | null | null | null | null | null | 4 | P 31 | P 31 | null | - C12 H10 N2 O - | - C12 H8 N2 O - | - C108 H72 N18 O9 - | 9 | 3 | TA1000 | Tian, Y.-P.; Duan, C.-Y.; Xu, X.-X.; You, X.-Z. | Screw-Chain Structure of 1,10-Phenanthroline Hydrate, C~12~H~8~N~2~.H~2~O | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2309 | 2312 | 10.1107/S010827019500549X | 0.71073 | MoKα | null | 0.07 | null | null | 0.061 | null | null | null | null | 1.77 | 1.77 | null | null | null | has coordinates | Tian, Y.-P.; Duan, C.-Y.; Xu, X.-X.; You, X.-Z.
Screw-Chain Structure of 1,10-Phenanthroline Hydrate, C~12~H~8~N~2~.H~2~O
Acta Crystallographica Section C
51(11)
(1995)
2309-2312 | 281,832 | 2023-03-13 | 7:40:49 | #------------------------------------------------------------------------------
#$Date: 2023-03-13 09:35:08 +0200 (Mon, 13 Mar 2023) $
#$Revision: 281832 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004188.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,189 | 13.887 | 0.002 | 8.121 | 0.001 | 16.201 | 0.003 | 90 | null | 98.15 | 0.01 | 90 | null | 1,808.6 | 0.5 | 300 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C20 H25 N O2 S - | - C20 H25 N O2 S - | - C80 H100 N4 O8 S4 - | 4 | 1 | VJ1009 | Das, B. C.; Pain (Biswas), S.; Biswas, G.; Ganguly, S. N.; Banerjee, A.; Duax, W. L.; Maji, B. B.; Ghatak, K. L. | Tropinyl 2-Isopropylbenzo[<i>b</i>]thiophene-3-carboxylate, C~20~H~25~NO~2~S | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2386 | 2388 | 10.1107/S0108270195004872 | 0.71073 | MoKα | null | 0.04 | null | null | 0.041 | null | null | null | null | 1.01 | 1.01 | null | null | null | has coordinates | Das, B. C.; Pain (Biswas), S.; Biswas, G.; Ganguly, S. N.; Banerjee, A.; Duax, W. L.; Maji, B. B.; Ghatak, K. L.
Tropinyl 2-Isopropylbenzo[<i>b</i>]thiophene-3-carboxylate, C~20~H~25~NO~2~S
Acta Crystallographica Section C
51(11)
(1995)
2386-2388 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004189.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,190 | 11.346 | 0.002 | 12.305 | 0.001 | 14.327 | 0.001 | 90 | null | 90 | null | 90 | null | 2,000.2 | 0.4 | 295 | null | null | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | - C19 H22 Cl N5 O4 - | - C19 H22 Cl N5 O4 - | - C76 H88 Cl4 N20 O16 - | 4 | 1 | VJ1015 | Das, A. K.; Bertolasi, V. | <i>N</i>-[1-Phenyl-2(<i>R</i>)-propyl]-2-chloroadenosine. An Activating Agent of the Adenosine A2 Receptor | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2408 | 2409 | 10.1107/S0108270195004793 | 0.71069 | MoKα | null | 0.0366 | null | null | 0.0452 | null | null | null | null | 0.57 | 0.57 | null | null | null | has coordinates | Das, A. K.; Bertolasi, V.
<i>N</i>-[1-Phenyl-2(<i>R</i>)-propyl]-2-chloroadenosine. An Activating Agent of the Adenosine A2 Receptor
Acta Crystallographica Section C
51(11)
(1995)
2408-2409 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004190.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,191 | 9.397 | 0.006 | 9.627 | 0.008 | 13.805 | 0.008 | 96.2 | 0.06 | 102.31 | 0.05 | 115.17 | 0.06 | 1,076.1 | 1.5 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C17 H20 N8 S4 - | - C17 H20 N8 S4 - | - C34 H40 N16 S8 - | 2 | 1 | VJ1023 | Biswas, G.; Chandra, T.; Avasthi, K.; Maulik, P. R. | 1,3-Bis[4,6-bis(methylthio)-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-1-yl]propane | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2453 | 2455 | 10.1107/S0108270195006524 | 0.71073 | MoKα | null | 0.037 | null | null | 0.079 | null | null | null | null | 0.782 | 0.782 | null | null | null | has coordinates | Biswas, G.; Chandra, T.; Avasthi, K.; Maulik, P. R.
1,3-Bis[4,6-bis(methylthio)-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-1-yl]propane
Acta Crystallographica Section C
51(11)
(1995)
2453-2455 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004191.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,192 | 12.416 | 0.001 | 6.391 | 0.001 | 15.552 | 0.002 | 90 | null | 90 | null | 90 | null | 1,234.1 | 0.3 | 295 | null | 295 | null | null | null | null | null | 5 | P n m a | -P 2ac 2n | 62 | - C6 H12 Hg I2 N4 - | - C6 Hg I2 N4 - | - C24 Hg4 I8 N16 - | 4 | 0.5 | NA1153 | Svensson, P. H.; Bengtsson-Kloo, L. A.; Stegemann, H. | (Hexamethylenetetramine)diiodomercury(II), HgI~2~.hmt | Acta Crystallographica Section C | 1,995 | 51 | 11 | 2289 | 2292 | 10.1107/S0108270195005567 | 0.7109 | MoKα | null | 0.0335 | null | null | 0.0344 | null | null | null | null | 2.07 | 2.07 | null | null | null | has coordinates | Svensson, P. H.; Bengtsson-Kloo, L. A.; Stegemann, H.
(Hexamethylenetetramine)diiodomercury(II), HgI~2~.hmt
Acta Crystallographica Section C
51(11)
(1995)
2289-2292 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004192.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,193 | 7.346 | 0.001 | 5.87 | 0.002 | 15.959 | 0.003 | 90 | null | 99.64 | 0.01 | 90 | null | 678.5 | 0.3 | 300 | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C13 H17 F O3 S - | - C13 H17 F O3 S - | - C26 H34 F2 O6 S2 - | 2 | 1 | AB1200 | Yakoubi, A.; Kallel, A.; Bizid, A.; Baklouti, A. | <i>trans</i>-2-Fluorocyclohexyl <i>p</i>-Toluenesulfonate and <i>trans</i>-2-Fluorocycloheptyl <i>p</i>-Toluenesulfonate | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2705 | 2707 | 10.1107/S0108270195008080 | 0.71073 | MoKα | null | 0.029 | null | null | 0.032 | null | null | null | null | 1.1 | 1.1 | null | null | null | has coordinates | Yakoubi, A.; Kallel, A.; Bizid, A.; Baklouti, A.
<i>trans</i>-2-Fluorocyclohexyl <i>p</i>-Toluenesulfonate and <i>trans</i>-2-Fluorocycloheptyl <i>p</i>-Toluenesulfonate
Acta Crystallographica Section C
51(12)
(1995)
2705-2707 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004193.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,194 | 6.022 | 0.001 | 7.319 | 0.001 | 32.279 | 0.005 | 90 | null | 90 | null | 90 | null | 1,422.7 | 0.4 | 300 | null | null | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | - C14 H19 F O3 S - | - C14 H19 F O3 S - | - C56 H76 F4 O12 S4 - | 4 | 1 | AB1200 | Yakoubi, A.; Kallel, A.; Bizid, A.; Baklouti, A. | <i>trans</i>-2-Fluorocyclohexyl <i>p</i>-Toluenesulfonate and <i>trans</i>-2-Fluorocycloheptyl <i>p</i>-Toluenesulfonate | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2705 | 2707 | 10.1107/S0108270195008080 | 0.71073 | MoKα | null | 0.044 | null | null | 0.046 | null | null | null | null | 1.6 | 1.6 | null | null | null | has coordinates | Yakoubi, A.; Kallel, A.; Bizid, A.; Baklouti, A.
<i>trans</i>-2-Fluorocyclohexyl <i>p</i>-Toluenesulfonate and <i>trans</i>-2-Fluorocycloheptyl <i>p</i>-Toluenesulfonate
Acta Crystallographica Section C
51(12)
(1995)
2705-2707 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004194.cif $
#-------------------------------------------------------------------... | |||||||||||
4,322,310 | 15.289 | 0.002 | 15.289 | 0.002 | 15.289 | 0.002 | 90 | null | 90 | null | 90 | null | 3,573.9 | 0.8 | 295 | null | 295 | null | null | null | null | null | ? | 7 | P 21 3 | P 2ac 2ab 3 | 198 | - C36 H26 Cr Li N6 O13 Ru - | - C36 H24 Cr Li N6 O13 Ru - | - C144 H96 Cr4 Li4 N24 O52 Ru4 - | 4 | 0.333333 | Román Andrés; Michel Gruselle; Bernard Malézieux; Michel Verdaguer; Jacqueline Vaissermann | Enantioselective Synthesis of Optically Active Polymeric Homo- and Bimetallic Oxalate-Bridged Networks [M2(ox)3]n | Inorganic Chemistry | 1,999 | 38 | 4637 | 4646 | 10.1021/ic9904135 | 0.71069 | MoKα | null | 0.0305 | null | null | 0.0351 | null | null | null | null | 1.1143 | 1.1143 | null | null | null | has coordinates | Román Andrés; Michel Gruselle; Bernard Malézieux; Michel Verdaguer; Jacqueline Vaissermann
Enantioselective Synthesis of Optically Active Polymeric Homo- and Bimetallic Oxalate-Bridged Networks [M2(ox)3]n
Inorganic Chemistry
38
(1999)
4637-4646 | 211,332 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-10-05 15:19:55 +0300 (Fri, 05 Oct 2018) $
#$Revision: 211332 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/23/4322310.cif $
#-------------------------------------------------------------------... | ||||||||||||
2,004,195 | 6.576 | 0.002 | 7.517 | 0.002 | 8.227 | 0.003 | 89.88 | 0.05 | 70.69 | 0.05 | 74 | 0.05 | 367.1 | 0.3 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C5 H9 N S2 - | - C5 H9 N S2 - | - C10 H18 N2 S4 - | 2 | 1 | AB1269 | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M. | Six Substituted Thiazolidine-2-thiones | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2661 | 2665 | 10.1107/S0108270195007955 | 0.71073 | MoKα | null | 0.047 | null | null | 0.045 | null | null | null | null | 0.539 | 0.539 | null | null | null | has coordinates | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
Six Substituted Thiazolidine-2-thiones
Acta Crystallographica Section C
51(12)
(1995)
2661-2665 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004195.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,196 | 6.312 | 0.002 | 10.036 | 0.003 | 11.887 | 0.004 | 90 | null | 105.39 | 0.05 | 90 | null | 726 | 0.4 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C5 H9 N S2 - | - C5 H9 N S2 - | - C20 H36 N4 S8 - | 4 | 1 | AB1269 | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M. | Six Substituted Thiazolidine-2-thiones | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2661 | 2665 | 10.1107/S0108270195007955 | 0.71073 | MoKα | null | 0.063 | null | null | 0.072 | null | null | null | null | 1.59 | 1.59 | null | null | null | has coordinates | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
Six Substituted Thiazolidine-2-thiones
Acta Crystallographica Section C
51(12)
(1995)
2661-2665 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004196.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,197 | 9.465 | 0.003 | 7.036 | 0.002 | 12.236 | 0.004 | 90 | null | 93.15 | 0.05 | 90 | null | 813.6 | 0.4 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C6 H11 N S2 - | - C6 H11 N S2 - | - C24 H44 N4 S8 - | 4 | 1 | AB1269 | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M. | Six Substituted Thiazolidine-2-thiones | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2661 | 2665 | 10.1107/S0108270195007955 | 0.71073 | MoKα | null | 0.062 | null | null | 0.074 | null | null | null | null | 1.42 | 1.42 | null | null | null | has coordinates | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
Six Substituted Thiazolidine-2-thiones
Acta Crystallographica Section C
51(12)
(1995)
2661-2665 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004197.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,198 | 8.583 | 0.003 | 8.71 | 0.003 | 17.03 | 0.006 | 90 | null | 90 | null | 90 | null | 1,273.1 | 0.8 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C4 H7 N S2 - | - C4 H7 N S2 - | - C32 H56 N8 S16 - | 8 | 2 | AB1269 | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M. | Six Substituted Thiazolidine-2-thiones | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2661 | 2665 | 10.1107/S0108270195007955 | 0.71073 | MoKα | null | 0.045 | null | null | 0.04 | null | null | null | null | 1.209 | 1.209 | null | null | null | has coordinates | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
Six Substituted Thiazolidine-2-thiones
Acta Crystallographica Section C
51(12)
(1995)
2661-2665 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004198.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,199 | 9.351 | 0.003 | 9.098 | 0.003 | 10.838 | 0.003 | 90 | null | 81.54 | 0.05 | 90 | null | 912 | 0.5 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C7 H13 N S2 - | - C7 H13 N S2 - | - C28 H52 N4 S8 - | 4 | 1 | AB1269 | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M. | Six Substituted Thiazolidine-2-thiones | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2661 | 2665 | 10.1107/S0108270195007955 | 0.71073 | MoKα | null | 0.0352 | null | null | 0.0345 | null | null | null | null | 0.701 | 0.701 | null | null | null | has coordinates | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
Six Substituted Thiazolidine-2-thiones
Acta Crystallographica Section C
51(12)
(1995)
2661-2665 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/41/2004199.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,200 | 13.494 | 0.004 | 8.205 | 0.003 | 7.491 | 0.002 | 90 | null | 90 | null | 90 | null | 829.4 | 0.4 | 293 | null | null | null | null | null | null | null | 4 | P n a 21 | P 2c -2n | 33 | - C6 H11 N S2 - | - C6 H11 N S2 - | - C24 H44 N4 S8 - | 4 | 1 | AB1269 | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M. | Six Substituted Thiazolidine-2-thiones | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2661 | 2665 | 10.1107/S0108270195007955 | 0.71073 | MoKα | null | 0.0398 | null | null | 0.0383 | null | null | null | null | 0.556 | 0.556 | null | null | null | has coordinates | Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
Six Substituted Thiazolidine-2-thiones
Acta Crystallographica Section C
51(12)
(1995)
2661-2665 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/42/2004200.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,201 | 9.432 | 0.001 | 12.08 | 0.002 | 12.542 | 0.002 | 97.98 | 0.01 | 96.42 | 0.01 | 107.87 | 0.01 | 1,328.7 | 0.4 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C29 H32 N6 O4 - | - C29 H32 N6 O5 - | - C58 H64 N12 O10 - | 2 | 1 | AB1278 | Karczmarzyk, Z.; Karolak-Wojciechowska, J.; Pawlowski, M. | 7-[3-(Dibenzylamino)-2-hydroxypropyl]-8-(furfurylamino)theophylline | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2608 | 2610 | 10.1107/S0108270195008547 | 1.54184 | CuKα | null | 0.0563 | null | null | 0.0723 | null | null | null | null | 1.49 | 1.49 | null | null | null | has coordinates | Karczmarzyk, Z.; Karolak-Wojciechowska, J.; Pawlowski, M.
7-[3-(Dibenzylamino)-2-hydroxypropyl]-8-(furfurylamino)theophylline
Acta Crystallographica Section C
51(12)
(1995)
2608-2610 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/42/2004201.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,202 | 12.0126 | 0.0008 | 13.075 | 0.002 | 7.4562 | 0.0008 | 90 | null | 90 | null | 90 | null | 1,171.1 | 0.2 | 293 | 2 | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | - C15 H10 O3 - | - C15 H10 O3 - | - C60 H40 O12 - | 4 | 1 | AS1193 | Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A. | 7-Hydroxy-3-phenylcoumarin, C~15~H~10~O~3~ | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2712 | 2714 | 10.1107/S0108270195008821 | 1.54184 | CuKα | null | 0.038 | null | null | 0.043 | null | null | null | null | 2.01 | 2.01 | null | null | null | has coordinates | Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.
7-Hydroxy-3-phenylcoumarin, C~15~H~10~O~3~
Acta Crystallographica Section C
51(12)
(1995)
2712-2714 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/42/2004202.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,203 | 12.421 | 0.008 | 12.67 | 0.007 | 18.45 | 0.009 | 90 | null | 95.48 | 0.05 | 90 | null | 2,890 | 3 | 298 | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | - C30 H48 N2 O - | - C30 H48 N2 O - | - C120 H192 N8 O4 - | 4 | 1 | AS1196 | Satake, K.; Hattori, T.; Kimura, M.; Kashino, S. | <i>N</i>-Acetyl-3,6-di-<i>tert</i>-butyl-2-(3,6-di-<i>tert</i>-butyl-3<i>H</i>-azepin-2-yl)-2,3-dihydro-1<i>H</i>-azepine | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2707 | 2710 | 10.1107/S0108270195008833 | 0.71073 | MoKα | null | 0.047 | null | null | 0.03 | null | null | null | null | 1.33 | 1.33 | null | null | null | has coordinates | Satake, K.; Hattori, T.; Kimura, M.; Kashino, S.
<i>N</i>-Acetyl-3,6-di-<i>tert</i>-butyl-2-(3,6-di-<i>tert</i>-butyl-3<i>H</i>-azepin-2-yl)-2,3-dihydro-1<i>H</i>-azepine
Acta Crystallographica Section C
51(12)
(1995)
2707-2710 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/42/2004203.cif $
#-------------------------------------------------------------------... | |||||||||||
2,004,204 | 18.248 | 0.001 | 4.442 | 0.003 | 15.913 | 0.002 | 90 | null | 98.366 | 0.006 | 90 | null | 1,276.1 | 0.9 | 296 | null | null | null | null | null | null | null | 5 | C 1 2 1 | null | - C4 H4 I N3 O - | - C4 H4 I N3 O - | - C32 H32 I8 N24 O8 - | 8 | 2 | AS1199 | Okabe, N.; Tamaki, K.; Suga, T. | 5-Iodocytosine | Acta Crystallographica Section C | 1,995 | 51 | 12 | 2696 | 2698 | 10.1107/S0108270195008845 | 0.71069 | MoKα | null | 0.04 | null | null | 0.045 | null | null | null | null | 1.75 | 1.75 | null | null | null | has coordinates | Okabe, N.; Tamaki, K.; Suga, T.
5-Iodocytosine
Acta Crystallographica Section C
51(12)
(1995)
2696-2698 | 301,791 | 2025-08-18 | 23:15:25 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/42/2004204.cif $
#-------------------------------------------------------------------... |