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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,000,748 | 7.538 | 0.001 | 7.416 | 0.003 | 30.803 | 0.004 | 90 | null | 90 | null | 90 | null | 1,722 | 1 | null | null | null | null | null | null | null | null | 5 | A e m a | -A 2ab 2ab | 64 | - C8 H24 Cd Cl4 N2 - | - C16 Cd Cl4 N4 - | - C64 Cd4 Cl16 N16 - | 4 | 0.25 | MU0240 | Doudin, B.; Chapuis, G. | Structure of bis(<i>n</i>-butylammonium) tetrachlorocadmate(II) | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1218 | 1220 | 10.1107/S010827019101452X | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Doudin, B.; Chapuis, G.
Structure of bis(<i>n</i>-butylammonium) tetrachlorocadmate(II)
Acta Crystallographica Section C
48(7)
(1992)
1218-1220 | 208,233 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,000,749 | 10.081 | 0.004 | 13.339 | 0.004 | 15.083 | 0.003 | 85.24 | 0.04 | 82.673 | 0.005 | 67.37 | 0.04 | 1,855.5 | 1.1 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C45 H57 Cl U - | - C45 H57 Cl U - | - C90 H114 Cl2 U2 - | 2 | 1 | AB0235 | Spirlet, M. R.; Rebizant, J.; Bettonville, S.; Goffart, J. | Structure of chlorotris(1,2,4,5,6,7-hexamethylindenyl)uranium(IV) | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1221 | 1223 | 10.1107/S0108270191014592 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Spirlet, M. R.; Rebizant, J.; Bettonville, S.; Goffart, J.
Structure of chlorotris(1,2,4,5,6,7-hexamethylindenyl)uranium(IV)
Acta Crystallographica Section C
48(7)
(1992)
1221-1223 | 208,360 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-06-14 04:32:00 +0300 (Thu, 14 Jun 2018) $
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2,000,750 | 21.37 | 0.02 | 22.04 | 0.01 | 8.66 | 0.01 | 90 | null | 90 | null | 90 | null | 4,079 | 6 | null | null | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | 19 | - C20 H44 Ba2 N10 O28 P2 - | - C20 H44 Ba2 N10 O28 P2 - | - C80 H176 Ba8 N40 O112 P8 - | 4 | 1 | SE0083 | Churchill, M. E. A.; Pritchard, R. G.; Helliwell, M. | Structure of barium guanosine 5'-monophosphate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1223 | 1227 | 10.1107/S0108270192001136 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Churchill, M. E. A.; Pritchard, R. G.; Helliwell, M.
Structure of barium guanosine 5'-monophosphate
Acta Crystallographica Section C
48(7)
(1992)
1223-1227 | 208,466 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-06-17 18:45:41 +0300 (Sun, 17 Jun 2018) $
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2,000,751 | 15.408 | 0.006 | 19.974 | 0.007 | 23.264 | 0.011 | 107.78 | 0.04 | 103.54 | 0.04 | 101.51 | 0.03 | 6,338 | 5 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C18 H16 Ge O - | - C18 H16 Ge O - | - C288 H256 Ge16 O16 - | 16 | 8 | MU0293 | Ferguson, G.; Gallagher, J. F.; Murphy, D.; Spalding, T. R.; Glidewell, C.; Holden, H. D. | The structure of triphenylgermanium hydroxide | Acta Crystallographica, Section C: Crystal Structure Communications | 1,992 | 48 | 7 | 1228 | 1231 | 10.1107/S0108270191015056 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Ferguson, G.; Gallagher, J. F.; Murphy, D.; Spalding, T. R.; Glidewell, C.; Holden, H. D.
The structure of triphenylgermanium hydroxide
Acta Crystallographica, Section C: Crystal Structure Communications
48(7)
(1992)
1228-1231 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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7,205,786 | 7.772 | 0.003 | 11.979 | 0.004 | 13.235 | 0.005 | 90 | null | 104.844 | 0.005 | 90 | null | 1,191.1 | 0.8 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C13 H6 Br N O3 S - | - C13 H6 Br N O3 S - | - C52 H24 Br4 N4 O12 S4 - | 4 | 1 | Jacob, C.; da Piedade, Fátima M.; Robalo, M. Paula; Duarte, M. Teresa | Evaluation of intermolecular interactions in thioxanthone derivatives: substituent effect on crystal diversity | CrystEngComm | 2,011 | 13 | 7 | 2604 | 10.1039/c0ce00783h | 1.5418 | CuKα | 0.1099 | 0.0847 | null | null | 0.2288 | 0.2477 | null | null | null | null | null | 1.048 | null | null | has coordinates | Jacob, C.; da Piedade, Fátima M.; Robalo, M. Paula; Duarte, M. Teresa
Evaluation of intermolecular interactions in thioxanthone derivatives: substituent effect on crystal diversity
CrystEngComm
13(7)
(2011)
2604 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
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2,000,752 | 12.413 | 0.003 | 14.645 | 0.003 | 12.287 | 0.002 | 90 | null | 90 | null | 90 | null | 2,233.6 | 0.8 | null | null | null | null | null | null | null | null | 6 | P b c n | null | - C20 H16 Cl2 Cu N4 O8 - | - C20 H16 Cl2 Cu N4 O8 - | - C80 H64 Cl8 Cu4 N16 O32 - | 4 | 0.5 | AS0546 | Chen, C.; Xu, D.; Xu, Y.; Cheng, C.; Ling, R. | Structure of <i>catena</i>-poly[{(2,2'-bipyridyl)(diperchlorato)copper(II)}-μ-4,4'-bipyridyl] | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1231 | 1233 | 10.1107/S0108270191014361 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Chen, C.; Xu, D.; Xu, Y.; Cheng, C.; Ling, R.
Structure of <i>catena</i>-poly[{(2,2'-bipyridyl)(diperchlorato)copper(II)}-μ-4,4'-bipyridyl]
Acta Crystallographica Section C
48(7)
(1992)
1231-1233 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
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2,000,753 | 6.7 | 0.001 | 20.911 | 0.009 | 9.609 | 0.002 | 90 | null | 104.24 | 0.02 | 90 | null | 1,304.9 | 0.7 | null | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | null | - C16 H36 F12 N2 O4 P2 - | - C16 H36 F28 N2 O4 P2 - | - C32 H72 F56 N4 O8 P4 - | 2 | 0.5 | GE0275 | Suwińska, K. | Structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyldiazonia-18-crown-6 with PF^{-^}~6~ and I^{-^} as the counterions | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1234 | 1237 | 10.1107/S0108270191013690 | 1.54178 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Suwińska, K.
Structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyldiazonia-18-crown-6 with PF^{-^}~6~ and I^{-^} as the counterions
Acta Crystallographica Section C
48(7)
(1992)
1234-1237 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
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2,000,754 | 6.482 | 0.001 | 16.932 | 0.002 | 10.871 | 0.001 | 90 | null | 106.63 | 0.02 | 90 | null | 1,143.2 | 0.3 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C16 H36 I2 N2 O4 - | - C16 H36 I2 N2 O4 - | - C32 H72 I4 N4 O8 - | 2 | 0.5 | GE0275 | Suwińska, K. | Structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyldiazonia-18-crown-6 with PF^{-^}~6~ and I^{-^} as the counterions | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1234 | 1237 | 10.1107/S0108270191013690 | 0.71078 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Suwińska, K.
Structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyldiazonia-18-crown-6 with PF^{-^}~6~ and I^{-^} as the counterions
Acta Crystallographica Section C
48(7)
(1992)
1234-1237 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,755 | 13.602 | 0.001 | 14.477 | 0.002 | 6.969 | 0.001 | 90 | null | 90 | null | 90 | null | 1,372.3 | 0.3 | null | null | null | null | null | null | null | null | 4 | P c a b | -P 2bc 2ac | 61 | 2,4-dioxido-1,2,3,4-benzotetrazine-2,4-diium | - C6 H4 N4 O2 - | - C6 H4 N4 O2 - | - C48 H32 N32 O16 - | 8 | 1 | AS0556 | Yamaguchi, K.; Takahashi, H.; Kaihoh, T.; Itoh, T.; Okada, M.; Nagata, K.; Matsumura, G.; Ohsawa, A. | Structure of benzo-1,2,3,4-tetrazine 1,3-dioxide | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1237 | 1239 | 10.1107/S0108270191013781 | 1.5405 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Yamaguchi, K.; Takahashi, H.; Kaihoh, T.; Itoh, T.; Okada, M.; Nagata, K.; Matsumura, G.; Ohsawa, A.
Structure of benzo-1,2,3,4-tetrazine 1,3-dioxide
Acta Crystallographica Section C
48(7)
(1992)
1237-1239 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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7,205,785 | 16.309 | 0.004 | 6.7318 | 0.0016 | 13.206 | 0.006 | 90 | null | 121.757 | 0.009 | 90 | null | 1,232.8 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/m 1 | -C 2y | 12 | - C13 H10 N2 O4 S - | - C13 H10 N2 O4 S - | - C52 H40 N8 O16 S4 - | 4 | 0.5 | Jacob, C.; da Piedade, Fátima M.; Robalo, M. Paula; Duarte, M. Teresa | Evaluation of intermolecular interactions in thioxanthone derivatives: substituent effect on crystal diversity | CrystEngComm | 2,011 | 13 | 7 | 2604 | 10.1039/c0ce00783h | 0.71073 | MoKα | 0.1 | 0.0485 | null | null | 0.0813 | 0.0981 | null | null | null | null | null | 1.012 | null | null | has coordinates | Jacob, C.; da Piedade, Fátima M.; Robalo, M. Paula; Duarte, M. Teresa
Evaluation of intermolecular interactions in thioxanthone derivatives: substituent effect on crystal diversity
CrystEngComm
13(7)
(2011)
2604 | 180,388 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-26 17:20:13 +0200 (Sat, 26 Mar 2016) $
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2,000,756 | 9.385 | 0.004 | 12.314 | 0.004 | 18.573 | 0.006 | 90 | null | 90 | null | 90 | null | 2,146.4 | 1.3 | null | null | null | null | null | null | null | null | 4 | P b n 21 | P 2c -2ab | 33 | N-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone | - C25 H22 N2 O3 - | - C25 H22 N2 O3 - | - C100 H88 N8 O12 - | 4 | 1 | HE0036 | Mostafa, G.; Mukherjee, M.; Ray, S. | Structure of <i>N</i>-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1241 | 1243 | 10.1107/S0108270191013975 | 0.7107 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Mostafa, G.; Mukherjee, M.; Ray, S.
Structure of <i>N</i>-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone
Acta Crystallographica Section C
48(7)
(1992)
1241-1243 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,000,757 | 7.961 | 0.005 | 11.863 | 0.006 | 24.873 | 0.008 | 90 | null | 92.29 | 0.01 | 90 | null | 2,347 | 2 | null | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C27 H28 N2 O4 - | - C27 H28 N2 O4 - | - C108 H112 N8 O16 - | 4 | 1 | PA0228 | Warin, V.; Lamiot, J.; Baert, F.; Ait Mansour, H.; Houssin, R.; Lesieur, D. | Structure of 6-benzyl-5-(3,4-dimethoxybenzyl)-3-methyl-5,6,7,8-tetrahydro-3<i>H</i>-oxazolo[5,4-<i>g</i>]isoquinolin-2-one | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1243 | 1246 | 10.1107/S0108270191013720 | 0.7107 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Warin, V.; Lamiot, J.; Baert, F.; Ait Mansour, H.; Houssin, R.; Lesieur, D.
Structure of 6-benzyl-5-(3,4-dimethoxybenzyl)-3-methyl-5,6,7,8-tetrahydro-3<i>H</i>-oxazolo[5,4-<i>g</i>]isoquinolin-2-one
Acta Crystallographica Section C
48(7)
(1992)
1243-1246 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,758 | 16.454 | 0.003 | 17.353 | 0.003 | 17.674 | 0.001 | 90 | null | 90 | null | 90 | null | 5,046.4 | 1.3 | null | null | null | null | null | null | null | null | 4 | P b c a | -P 2ac 2ab | null | - C25 H27 N5 Si - | - C25 H27 N5 Si - | - C200 H216 N40 Si8 - | 8 | 1 | HA0095 | Whitby, R. J.; Webster, M.; Dennehy, R. D. | Structure of 6-(<i>tert</i>-butylimino)-4,4,5,5-tetracyano-3-(1-phenylethylidene)-1-(trimethylsilyl)cyclohex-1-ene | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1252 | 1253 | 10.1107/S0108270191014464 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Whitby, R. J.; Webster, M.; Dennehy, R. D.
Structure of 6-(<i>tert</i>-butylimino)-4,4,5,5-tetracyano-3-(1-phenylethylidene)-1-(trimethylsilyl)cyclohex-1-ene
Acta Crystallographica Section C
48(7)
(1992)
1252-1253 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,759 | 11.2191 | 0.0004 | 15.9824 | 0.0005 | 17.7311 | 0.0007 | 90 | null | 90 | null | 90 | null | 3,179.3 | 0.2 | null | null | null | null | null | null | null | null | 4 | C m c 21 | C 2c -2 | null | - C32 H46 N4 O8 - | - C32 H48 N4 O8 - | - C128 H192 N16 O32 - | 4 | 0.5 | GE0295 | Kanters, J. A.; Schouten, A.; Kroon, J.; Grech, E. | Complexes of the `proton sponge' 1,8-bis(dimethylamino)naphthalene (DMAN). IV. Structure of [DMANH]~2~^+^.[squarate]^2{-^} tetrahydrate at 100 K | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1254 | 1257 | 10.1107/S0108270191014348 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kanters, J. A.; Schouten, A.; Kroon, J.; Grech, E.
Complexes of the `proton sponge' 1,8-bis(dimethylamino)naphthalene (DMAN). IV. Structure of [DMANH]~2~^+^.[squarate]^2{-^} tetrahydrate at 100 K
Acta Crystallographica Section C
48(7)
(1992)
1254-1257 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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7,205,784 | 7.049 | 0.002 | 11.888 | 0.003 | 16.218 | 0.005 | 86.15 | 0.01 | 84.556 | 0.0014 | 86.298 | 0.0011 | 1,347.5 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C13 H8 Br N O4 S - | - C13 H8 Br N O4 S - | - C52 H32 Br4 N4 O16 S4 - | 4 | 2 | Jacob, C.; da Piedade, Fátima M.; Robalo, M. Paula; Duarte, M. Teresa | Evaluation of intermolecular interactions in thioxanthone derivatives: substituent effect on crystal diversity | CrystEngComm | 2,011 | 13 | 7 | 2604 | 10.1039/c0ce00783h | 1.5418 | CuKα | 0.1207 | 0.0605 | null | null | 0.1496 | 0.1695 | null | null | null | null | null | 0.951 | null | null | has coordinates | Jacob, C.; da Piedade, Fátima M.; Robalo, M. Paula; Duarte, M. Teresa
Evaluation of intermolecular interactions in thioxanthone derivatives: substituent effect on crystal diversity
CrystEngComm
13(7)
(2011)
2604 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
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2,000,760 | 8.63 | 0.001 | 9.908 | 0.004 | 13.549 | 0.016 | 107.73 | 0.03 | 94.96 | 0.05 | 112.51 | 0.03 | 991.9 | 1.3 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C26 H19 N O3 - | - C26 H19 N O3 - | - C52 H38 N2 O6 - | 2 | 1 | HA0079 | Hursthouse, M. B.; Karaulov, A. I.; Ciechanowicz-Rutkowska, M.; Kolasa, A.; Zankowska-Jasińska, W. | Structure of 3-benzoyl-4-methyl-1-phenyl-1,2,3,4-tetrahydro-5<i>H</i>-indeno[1,2-<i>b</i>]pyridine-2,5-dione | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1257 | 1260 | 10.1107/S0108270191014476 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Hursthouse, M. B.; Karaulov, A. I.; Ciechanowicz-Rutkowska, M.; Kolasa, A.; Zankowska-Jasińska, W.
Structure of 3-benzoyl-4-methyl-1-phenyl-1,2,3,4-tetrahydro-5<i>H</i>-indeno[1,2-<i>b</i>]pyridine-2,5-dione
Acta Crystallographica Section C
48(7)
(1992)
1257-1260 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,761 | 6.756 | 0.002 | 13.012 | 0.004 | 10.931 | 0.004 | 90 | null | 91.5 | 0.02 | 90 | null | 960.6 | 0.5 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C6 H9 B2 Br N4 - | - C6 H8 B2 Br N4 - | - C24 H32 B8 Br4 N16 - | 4 | 1 | CR0390 | Hodgkins, T. G.; Powell, D. R. | Structure of 4-bromopyrazabole | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1260 | 1262 | 10.1107/S0108270191013872 | 1.54178 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Hodgkins, T. G.; Powell, D. R.
Structure of 4-bromopyrazabole
Acta Crystallographica Section C
48(7)
(1992)
1260-1262 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
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2,000,762 | 12.456 | 0.002 | 6.735 | 0.004 | 16.135 | 0.003 | 90 | null | 92.17 | 0.01 | 90 | null | 1,352.6 | 0.9 | null | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | null | - C18 H15 N O3 - | - C18 H15 N O3 - | - C72 H60 N4 O12 - | 4 | 1 | GE0291 | Kaufmann, M.; Berger, D.; Härter, R.; Hirschi, D.; Bürgi, H.-B.; Raselli, A.; Röhr, C. | Structure of 1-morpholinoanthraquinone at 110 K | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1262 | 1265 | 10.1107/S0108270191014336 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kaufmann, M.; Berger, D.; Härter, R.; Hirschi, D.; Bürgi, H.-B.; Raselli, A.; Röhr, C.
Structure of 1-morpholinoanthraquinone at 110 K
Acta Crystallographica Section C
48(7)
(1992)
1262-1265 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,763 | 11.782 | 0.002 | 9.058 | 0.002 | 9.766 | 0.002 | 90 | null | 109.3 | 0.01 | 90 | null | 983.7 | 0.3 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C14 H28 N2 O8 S2 - | - C14 H28 N2 O8 S2 - | - C28 H56 N4 O16 S4 - | 2 | 0.5 | BX0561 | Paulus, E. F.; Porz, C. | Structure of <i>meso</i>-(<i>R</i>,<i>R</i>,<i>S</i>,<i>S</i>)-<i>trans</i>-4,5,4',5'-tetrahydroxy-2,2'-bi(1,3-thiaoxolane)-dimethylacetamide (1:2) | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1267 | 1269 | 10.1107/S0108270191014683 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Paulus, E. F.; Porz, C.
Structure of <i>meso</i>-(<i>R</i>,<i>R</i>,<i>S</i>,<i>S</i>)-<i>trans</i>-4,5,4',5'-tetrahydroxy-2,2'-bi(1,3-thiaoxolane)-dimethylacetamide (1:2)
Acta Crystallographica Section C
48(7)
(1992)
1267-1269 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,764 | 13.391 | 0.002 | 28.817 | 0.003 | 6.667 | 0.002 | 90 | null | 97.256 | 0.017 | 90 | null | 2,552.1 | 0.9 | null | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C29 H37 N O3 - | - C32 H2 N O3 - | - C128 H8 N4 O12 - | 4 | 1 | CR0359 | Luss, H. R.; Texter, J. | Structure of <i>N</i>-{2-[2,4-bis(1,1-dimethylpropyl)phenoxy]ethyl}-1-hydroxy-2-naphthalenecarboxamide | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1269 | 1272 | 10.1107/S0108270191013847 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Luss, H. R.; Texter, J.
Structure of <i>N</i>-{2-[2,4-bis(1,1-dimethylpropyl)phenoxy]ethyl}-1-hydroxy-2-naphthalenecarboxamide
Acta Crystallographica Section C
48(7)
(1992)
1269-1272 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
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7,205,783 | 9.9881 | 0.001 | 31.471 | 0.003 | 12.2888 | 0.0012 | 90 | null | 96.147 | 0.001 | 90 | null | 3,840.6 | 0.7 | 296 | 2 | 296 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C35 H35 Dy3 O23 - | - C35 H31 Dy3 O23 - | - C140 H124 Dy12 O92 - | 4 | 1 | Zhang, Hai-Juan; Wang, Xiao-Zhu; Zhu, Dun-Ru; Song, You; Xu, Yan; Xu, Heng; Shen, Xuan; Gao, Ting; Huang, Min-Xue | Novel 3D lanthanide-organic frameworks with an unusual infinite nanosized ribbon [Ln3(μ3‒OH)2(‒CO2)6]+n (Ln = Eu, Gd, Dy): syntheses, structures, luminescence, and magnetic properties | CrystEngComm | 2,011 | 13 | 7 | 2586 | 10.1039/c0ce00766h | 0.71073 | MoKα | 0.0497 | 0.0366 | null | null | 0.0899 | 0.1021 | null | null | null | null | null | 1.053 | null | null | has coordinates | Zhang, Hai-Juan; Wang, Xiao-Zhu; Zhu, Dun-Ru; Song, You; Xu, Yan; Xu, Heng; Shen, Xuan; Gao, Ting; Huang, Min-Xue
Novel 3D lanthanide-organic frameworks with an unusual infinite nanosized ribbon [Ln3(μ3‒OH)2(‒CO2)6]+n (Ln = Eu, Gd, Dy): syntheses, structures, luminescence, and magnetic properties
CrystEngComm
13(7)
(20... | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
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2,000,765 | 19.307 | 0.003 | 19.307 | 0.003 | 26.735 | 0.004 | 90 | null | 90 | null | 120 | null | 8,631 | 2 | null | null | null | null | null | null | null | null | 3 | R -3 :H | -R 3 | null | - C19 H16 O - | - C38 H30 O2 - | - C912 H720 O48 - | 24 | 1.33333 | MU0292 | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Low, J. N.; Scrimgeour, S. N. | The structure of triphenylmethanol, Ph~3~COH | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1272 | 1275 | 10.1107/S0108270191015044 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | warnings | has coordinates | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Low, J. N.; Scrimgeour, S. N.
The structure of triphenylmethanol, Ph~3~COH
Acta Crystallographica Section C
48(7)
(1992)
1272-1275 | 249,444 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2020-03-17 13:28:01 +0200 (Tue, 17 Mar 2020) $
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2,000,766 | 13.82 | 0.002 | 6.205 | 0.001 | 17.55 | 0.003 | 90 | null | 106.06 | 0.01 | 90 | null | 1,446.2 | 0.4 | null | null | null | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | null | - C12 H20 I N O2 - | - C12 H20 I N O2 - | - C48 H80 I4 N4 O8 - | 4 | 1 | CD0061 | Friesen, R. W.; Kolaczewska, A. E.; Lough, A. J. | <i>trans</i>-5-(<i>n</i>-Heptyl)-4-(1-iodovinyl)-2-oxazolidinone and <i>syn</i>-[4-cyclohexyl-2-iodo-3-(<i>N</i>-tosylamino)-1-buten-4-yl] acetate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1275 | 1279 | 10.1107/S0108270191014130 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Friesen, R. W.; Kolaczewska, A. E.; Lough, A. J.
<i>trans</i>-5-(<i>n</i>-Heptyl)-4-(1-iodovinyl)-2-oxazolidinone and <i>syn</i>-[4-cyclohexyl-2-iodo-3-(<i>N</i>-tosylamino)-1-buten-4-yl] acetate
Acta Crystallographica Section C
48(7)
(1992)
1275-1279 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,767 | 12.233 | 0.003 | 13.733 | 0.003 | 14.169 | 0.006 | 90 | null | 112.75 | 0.03 | 90 | null | 2,195.1 | 1.3 | null | null | null | null | null | null | null | null | 6 | P 1 21/a 1 | -P 2yab | null | - C19 H26 I N O4 S - | - C19 H26 I N O4 S - | - C76 H104 I4 N4 O16 S4 - | 4 | 1 | CD0061 | Friesen, R. W.; Kolaczewska, A. E.; Lough, A. J. | <i>trans</i>-5-(<i>n</i>-Heptyl)-4-(1-iodovinyl)-2-oxazolidinone and <i>syn</i>-[4-cyclohexyl-2-iodo-3-(<i>N</i>-tosylamino)-1-buten-4-yl] acetate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1275 | 1279 | 10.1107/S0108270191014130 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates,has disorder | Friesen, R. W.; Kolaczewska, A. E.; Lough, A. J.
<i>trans</i>-5-(<i>n</i>-Heptyl)-4-(1-iodovinyl)-2-oxazolidinone and <i>syn</i>-[4-cyclohexyl-2-iodo-3-(<i>N</i>-tosylamino)-1-buten-4-yl] acetate
Acta Crystallographica Section C
48(7)
(1992)
1275-1279 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,768 | 7.527 | 0.001 | 9.157 | 0.001 | 9.988 | 0.001 | 96.39 | 0.01 | 110.4 | 0.01 | 93.24 | 0.01 | 637.87 | 0.14 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C28 H30 N4 O2 S2 - | - C28 H30 N4 O2 S2 - | - C28 H30 N4 O2 S2 - | 1 | 0.5 | BX0570 | Mizuguchi, J.; Rihs, G. | Structures of complexes of 2,3,3a,5,6,6a-hexahydro-3,6-diphenyl-1<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dithione with <i>N</i>-methyl-2-pyrrolidone and dimethyl sulfoxide | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1279 | 1283 | 10.1107/S0108270191014701 | 0.70926 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Mizuguchi, J.; Rihs, G.
Structures of complexes of 2,3,3a,5,6,6a-hexahydro-3,6-diphenyl-1<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dithione with <i>N</i>-methyl-2-pyrrolidone and dimethyl sulfoxide
Acta Crystallographica Section C
48(7)
(1992)
1279-1283 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,769 | 12.674 | 0.001 | 10.318 | 0.001 | 8.761 | 0.001 | 90 | null | 100.32 | 0.01 | 90 | null | 1,127.14 | 0.19 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C22 H24 N2 O2 S4 - | - C22 H24 N2 O2 S4 - | - C44 H48 N4 O4 S8 - | 2 | 0.5 | BX0570 | Mizuguchi, J.; Rihs, G. | Structures of complexes of 2,3,3a,5,6,6a-hexahydro-3,6-diphenyl-1<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dithione with <i>N</i>-methyl-2-pyrrolidone and dimethyl sulfoxide | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1279 | 1283 | 10.1107/S0108270191014701 | 0.70926 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Mizuguchi, J.; Rihs, G.
Structures of complexes of 2,3,3a,5,6,6a-hexahydro-3,6-diphenyl-1<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dithione with <i>N</i>-methyl-2-pyrrolidone and dimethyl sulfoxide
Acta Crystallographica Section C
48(7)
(1992)
1279-1283 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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7,205,782 | 10.051 | 0.004 | 31.543 | 0.012 | 12.42 | 0.005 | 90 | null | 96.082 | 0.005 | 90 | null | 3,915 | 3 | 296 | 2 | 296 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C35 H35 Gd3 O23 - | - C35 H31 Gd3 O23 - | - C140 H124 Gd12 O92 - | 4 | 1 | Zhang, Hai-Juan; Wang, Xiao-Zhu; Zhu, Dun-Ru; Song, You; Xu, Yan; Xu, Heng; Shen, Xuan; Gao, Ting; Huang, Min-Xue | Novel 3D lanthanide-organic frameworks with an unusual infinite nanosized ribbon [Ln3(μ3‒OH)2(‒CO2)6]+n (Ln = Eu, Gd, Dy): syntheses, structures, luminescence, and magnetic properties | CrystEngComm | 2,011 | 13 | 7 | 2586 | 10.1039/c0ce00766h | 0.71073 | MoKα | 0.0405 | 0.0339 | null | null | 0.0734 | 0.0766 | null | null | null | null | null | 1.037 | null | null | has coordinates | Zhang, Hai-Juan; Wang, Xiao-Zhu; Zhu, Dun-Ru; Song, You; Xu, Yan; Xu, Heng; Shen, Xuan; Gao, Ting; Huang, Min-Xue
Novel 3D lanthanide-organic frameworks with an unusual infinite nanosized ribbon [Ln3(μ3‒OH)2(‒CO2)6]+n (Ln = Eu, Gd, Dy): syntheses, structures, luminescence, and magnetic properties
CrystEngComm
13(7)
(20... | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
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2,000,770 | 23.08 | 0.03 | 7.842 | 0.003 | 28.081 | 0.013 | 90 | null | 105.97 | 0.07 | 90 | null | 4,886 | 7 | null | null | null | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | null | - C6 H2 Br2 N2 O2 - | - C6 H2 Br2 N2 O2 - | - C144 H48 Br48 N48 O48 - | 24 | 3 | CR0354 | Britton, D. | The crystal packing of 4,7-dibromobenzofurazan 1-oxide | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1283 | 1285 | 10.1107/S0108270191014774 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Britton, D.
The crystal packing of 4,7-dibromobenzofurazan 1-oxide
Acta Crystallographica Section C
48(7)
(1992)
1283-1285 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,771 | 6.105 | 0.002 | 16.634 | 0.003 | 14.356 | 0.003 | 90 | null | 90 | null | 90 | null | 1,457.9 | 0.6 | null | null | null | null | null | null | null | null | 4 | P b c n | null | - C18 H15 F2 P - | - C18 H15 F2 P - | - C72 H60 F8 P4 - | 4 | 0.5 | HH0563 | Doxsee, K. M.; Hanawalt, E. M.; Weakley, T. J. R. | Structure of difluorotriphenylphosphorane | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1288 | 1290 | 10.1107/S0108270191014889 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Doxsee, K. M.; Hanawalt, E. M.; Weakley, T. J. R.
Structure of difluorotriphenylphosphorane
Acta Crystallographica Section C
48(7)
(1992)
1288-1290 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,772 | 13.561 | 0.004 | 6.598 | 0.001 | 14.108 | 0.004 | 90 | null | 118.37 | 0.02 | 90 | null | 1,110.7 | 0.5 | null | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | null | - C13 H14 O3 - | - C13 H14 O3 - | - C52 H56 O12 - | 4 | 1 | HH0572 | Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P. | Three substituted hexahydro-5,8-dimethanonaphthalenes | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1290 | 1294 | 10.1107/S0108270191014877 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P.
Three substituted hexahydro-5,8-dimethanonaphthalenes
Acta Crystallographica Section C
48(7)
(1992)
1290-1294 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,000,773 | 6.556 | 0.002 | 25.739 | 0.01 | 7.436 | 0.005 | 90 | null | 111.25 | 0.04 | 90 | null | 1,169.5 | 1 | null | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C12 H10 Br2 O2 - | - C12 H10 Br2 O2 - | - C48 H40 Br8 O8 - | 4 | 1 | HH0572 | Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P. | Three substituted hexahydro-5,8-dimethanonaphthalenes | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1290 | 1294 | 10.1107/S0108270191014877 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P.
Three substituted hexahydro-5,8-dimethanonaphthalenes
Acta Crystallographica Section C
48(7)
(1992)
1290-1294 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,774 | 10.827 | 0.004 | 8.395 | 0.002 | 12.997 | 0.002 | 90 | null | 105.34 | 0.02 | 90 | null | 1,139.2 | 0.5 | null | null | null | null | null | null | null | null | 3 | C 1 c 1 | C -2yc | null | - C13 H16 O3 - | - C13 H16 O3 - | - C52 H64 O12 - | 4 | 1 | HH0572 | Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P. | Three substituted hexahydro-5,8-dimethanonaphthalenes | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1290 | 1294 | 10.1107/S0108270191014877 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P.
Three substituted hexahydro-5,8-dimethanonaphthalenes
Acta Crystallographica Section C
48(7)
(1992)
1290-1294 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,775 | 8.604 | 0.002 | 14.29 | 0.004 | 24.924 | 0.004 | 90 | null | 90 | null | 90 | null | 3,064.4 | 1.2 | null | null | null | null | null | null | null | null | 6 | P b c a | null | - C14 H10 F3 N3 O2 S - | - C14 H10 F3 N3 O2 S - | - C112 H80 F24 N24 O16 S8 - | 8 | 1 | CR0380 | Wang, X.; Deng, R.; Wu, J.; Chen, Z. | Structure of 2-thionyltrifluoroacetone isonicotinyl hydrazone | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1295 | 1297 | 10.1107/S0108270191014762 | 0.7107 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Wang, X.; Deng, R.; Wu, J.; Chen, Z.
Structure of 2-thionyltrifluoroacetone isonicotinyl hydrazone
Acta Crystallographica Section C
48(7)
(1992)
1295-1297 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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7,205,781 | 10.099 | 0.002 | 31.64 | 0.007 | 12.45 | 0.003 | 90 | null | 95.854 | 0.002 | 90 | null | 3,957.4 | 1.5 | 296 | 2 | 296 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C35 H35 Eu3 O23 - | - C35 H31 Eu3 O23 - | - C140 H124 Eu12 O92 - | 4 | 1 | Zhang, Hai-Juan; Wang, Xiao-Zhu; Zhu, Dun-Ru; Song, You; Xu, Yan; Xu, Heng; Shen, Xuan; Gao, Ting; Huang, Min-Xue | Novel 3D lanthanide-organic frameworks with an unusual infinite nanosized ribbon [Ln3(μ3‒OH)2(‒CO2)6]+n (Ln = Eu, Gd, Dy): syntheses, structures, luminescence, and magnetic properties | CrystEngComm | 2,011 | 13 | 7 | 2586 | 10.1039/c0ce00766h | 0.71073 | MoKα | 0.0376 | 0.0289 | null | null | 0.0674 | 0.0779 | null | null | null | null | null | 1.066 | null | null | has coordinates | Zhang, Hai-Juan; Wang, Xiao-Zhu; Zhu, Dun-Ru; Song, You; Xu, Yan; Xu, Heng; Shen, Xuan; Gao, Ting; Huang, Min-Xue
Novel 3D lanthanide-organic frameworks with an unusual infinite nanosized ribbon [Ln3(μ3‒OH)2(‒CO2)6]+n (Ln = Eu, Gd, Dy): syntheses, structures, luminescence, and magnetic properties
CrystEngComm
13(7)
(20... | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
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2,000,776 | 7.44 | 0.002 | 7.44 | 0.002 | 16.097 | 0.006 | 90 | null | 90 | null | 90 | null | 891 | 0.5 | null | null | null | null | null | null | null | null | 4 | P 4/n c c :1 | P 4ab 2n -1ab | 130 | - Ba Cu O10 Si4 - | - Ba2 Cu4 O10 Si4 - | - Ba8 Cu16 O40 Si16 - | 4 | 0.25 | BX0572 | Lin, H. C.; Liao, F. L.; Wang, S. L. | Structure of BaCuSi~4~O~10~ | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1297 | 1299 | 10.1107/S0108270192001203 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Lin, H. C.; Liao, F. L.; Wang, S. L.
Structure of BaCuSi~4~O~10~
Acta Crystallographica Section C
48(7)
(1992)
1297-1299 | 176,343 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-11 02:03:02 +0200 (Thu, 11 Feb 2016) $
#$Revision: 176343 $
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2,000,777 | 7.447 | 0.001 | 7.447 | 0.001 | 16.138 | 0.002 | 90 | null | 90 | null | 90 | null | 895 | 0.2 | null | null | null | null | null | null | null | null | 4 | P 4/n c c :1 | P 4ab 2n -1ab | 130 | - Ba Cu O10 Si4 - | - Ba Cu O10 Si4 - | - Ba4 Cu4 O40 Si16 - | 4 | 0.25 | AB0258 | Janczak, J.; Kubiak, R. | Refinement of the structure of barium copper silicate BaCu[Si~4~O~10~] at 300 K | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1299 | 1301 | 10.1107/S0108270191014580 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Janczak, J.; Kubiak, R.
Refinement of the structure of barium copper silicate BaCu[Si~4~O~10~] at 300 K
Acta Crystallographica Section C
48(7)
(1992)
1299-1301 | 176,343 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-11 02:03:02 +0200 (Thu, 11 Feb 2016) $
#$Revision: 176343 $
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2,000,778 | 4.41 | 0.002 | 4.41 | 0.002 | 24.27 | 0.02 | 90 | null | 90 | null | 120 | null | 408.8 | 0.4 | null | null | null | null | null | null | null | null | 3 | R -3 m | -R 3 2" | null | - Er K Te2 - | - Er K Te2 - | - Er3 K3 Te6 - | 3 | null | ST0551 | Keane, P. M.; Ibers, J. A. | Structure of KErTe~2~ | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1301 | 1303 | 10.1107/S0108270191014208 | 0.7093 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Keane, P. M.; Ibers, J. A.
Structure of KErTe~2~
Acta Crystallographica Section C
48(7)
(1992)
1301-1303 | 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/2/00/07/2000778.cif $
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2,000,779 | 14.902 | 0.001 | 10.815 | 0.004 | 14.941 | 0.001 | 90 | null | 103.29 | 0.01 | 90 | null | 2,343.5 | 0.9 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C26 H29 I N2 Pt - | - C26 H29 I N2 Pt - | - C104 H116 I4 N8 Pt4 - | 4 | 1 | GE0287 | Smeets, W. J. J.; Spek, A. L.; van Beek, J. A. M.; van Koten, G. | Structure of {<i>ad</i>,<i>be</i>-bis[(8-dimethylamino-κ<i>N</i>)naphthyl-κ<i>C</i>^1^]}-<i>f</i>-ethyl-<i>c</i>-iodoplatinum(IV) | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1303 | 1305 | 10.1107/S0108270192001616 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Smeets, W. J. J.; Spek, A. L.; van Beek, J. A. M.; van Koten, G.
Structure of {<i>ad</i>,<i>be</i>-bis[(8-dimethylamino-κ<i>N</i>)naphthyl-κ<i>C</i>^1^]}-<i>f</i>-ethyl-<i>c</i>-iodoplatinum(IV)
Acta Crystallographica Section C
48(7)
(1992)
1303-1305 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
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2,000,780 | 12.252 | 0.003 | 9.176 | 0.002 | 11.974 | 0.008 | 90 | null | 115.06 | 0.03 | 90 | null | 1,219.4 | 1 | null | null | null | null | null | null | null | null | 6 | P 1 21/a 1 | -P 2yab | null | - C12 H32 Cl8 N4 O2 Os - | - C12 H32 Cl8 N4 O2 Os - | - C24 H64 Cl16 N8 O4 Os2 - | 2 | 0.5 | AB0247 | Arrieta, J. M.; Germain, G.; Vlassi, M.; Craciunescu, D. G.; Parrondo Iglesias, E.; Debaerdemaeker, T. | Bis[2-(2-hydroxyethyl)piperazinium] hexachloroosmate(IV) dichloride | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1305 | 1307 | 10.1107/S0108270191014117 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Arrieta, J. M.; Germain, G.; Vlassi, M.; Craciunescu, D. G.; Parrondo Iglesias, E.; Debaerdemaeker, T.
Bis[2-(2-hydroxyethyl)piperazinium] hexachloroosmate(IV) dichloride
Acta Crystallographica Section C
48(7)
(1992)
1305-1307 | 199,607 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-08-07 04:53:34 +0300 (Mon, 07 Aug 2017) $
#$Revision: 199607 $
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2,000,781 | 8.545 | 0.003 | 3.8691 | 0.001 | 12.692 | 0.004 | 90 | null | 90 | null | 90 | null | 419.6 | 0.2 | null | null | null | null | null | null | null | null | 5 | P n m a | -P 2ac 2n | 62 | - C2 H3 Cl Cu N - | - C2 H3 Cl Cu N - | - C8 H12 Cl4 Cu4 N4 - | 4 | 0.5 | HA0086 | Jones, P. G. | Redetermination of the structure of (acetonitrile)chlorocopper(I) [(H~3~CCN)CuCl] at 178 K | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1307 | 1308 | 10.1107/S0108270191013926 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Jones, P. G.
Redetermination of the structure of (acetonitrile)chlorocopper(I) [(H~3~CCN)CuCl] at 178 K
Acta Crystallographica Section C
48(7)
(1992)
1307-1308 | 278,244 | 2022-09-28 | 13:56:22 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 16:56:03 +0300 (Wed, 28 Sep 2022) $
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7,205,780 | 13.5623 | 0.0016 | 7.2662 | 0.0009 | 15.2513 | 0.0013 | 90 | null | 123.605 | 0.007 | 90 | null | 1,251.8 | 0.3 | 296 | 2 | 296 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C22 H16 Cu4 N8 O14 - | - C22 H16 Cu4 N8 O14 - | - C44 H32 Cu8 N16 O28 - | 2 | 0.5 | Yang, En-Cui; Yang, You-Li; Liu, Zhong-Yi; Liu, Kai-Sheng; Wu, Xiao-Yun; Zhao, Xiao-Jun | Two unique antiferromagnetic 3D frameworks with unusual CuII4 cluster and alternate CuII4 + CuII1 structural motif tuned by aromatic polycarboxylate coligand | CrystEngComm | 2,011 | 13 | 7 | 2667 | 10.1039/c0ce00764a | 0.71073 | MoKα | 0.0301 | 0.0259 | null | null | 0.0707 | 0.0728 | null | null | null | null | null | 1.045 | null | null | has coordinates | Yang, En-Cui; Yang, You-Li; Liu, Zhong-Yi; Liu, Kai-Sheng; Wu, Xiao-Yun; Zhao, Xiao-Jun
Two unique antiferromagnetic 3D frameworks with unusual CuII4 cluster and alternate CuII4 + CuII1 structural motif tuned by aromatic polycarboxylate coligand
CrystEngComm
13(7)
(2011)
2667 | 180,388 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-26 17:20:13 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180388 $
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2,000,782 | 7.674 | 0.002 | 11.113 | 0.003 | 13.346 | 0.004 | 71.64 | 0.02 | 79.49 | 0.02 | 86.62 | 0.02 | 1,062.1 | 0.5 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C18 H32 O4 Sn - | - C20 H36 O4 Sn - | - C40 H72 O8 Sn2 - | 2 | 1 | CD0062 | Bélanger-Gariépy, F.; Léger, R.; Hanessian, S. | Structure of a bicyclic organostannane resulting from a trimethyltin hydride addition-cyclization reaction | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1309 | 1310 | 10.1107/S0108270191013793 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Bélanger-Gariépy, F.; Léger, R.; Hanessian, S.
Structure of a bicyclic organostannane resulting from a trimethyltin hydride addition-cyclization reaction
Acta Crystallographica Section C
48(7)
(1992)
1309-1310 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,000,783 | 21.817 | 0.003 | 21.817 | 0.003 | 30.658 | 0.005 | 90 | null | 90 | null | 90 | null | 17,759 | 5 | null | null | null | null | null | null | null | null | 6 | I -4 2 d | I -4 2bw | null | - C65 H69 F12 N4 P10 Rh2 - | - C65 H69 F12 N4 P6 Rh2 - | - C520 H552 F96 N32 P48 Rh16 - | 8 | 0.5 | CR0383 | Tortorelli, L. J.; Woods, C.; Campana, C. F. | Structure of the mixed-valence complex [Rh~2~(μ-{(C~6~H~5~)~2~PCH~2~P(C~6~H~5~)~2~})~2~(μ-N~2~C~5~H~7~)(<i>tert</i>-C~4~H~9~NC)~2~](PF~6~)~2~ | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1311 | 1312 | 10.1107/S0108270191014294 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Tortorelli, L. J.; Woods, C.; Campana, C. F.
Structure of the mixed-valence complex [Rh~2~(μ-{(C~6~H~5~)~2~PCH~2~P(C~6~H~5~)~2~})~2~(μ-N~2~C~5~H~7~)(<i>tert</i>-C~4~H~9~NC)~2~](PF~6~)~2~
Acta Crystallographica Section C
48(7)
(1992)
1311-1312 | 203,310 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-11-18 03:07:15 +0200 (Sat, 18 Nov 2017) $
#$Revision: 203310 $
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2,000,784 | 14.141 | 0.004 | 20.209 | 0.005 | 14.207 | 0.004 | 90 | null | 95.85 | 0.03 | 90 | null | 4,038.9 | 1.9 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C37 H22 Au2 F10 P2 - | - C37 H22 Au2 F10 P2 - | - C148 H88 Au8 F40 P8 - | 4 | 1 | HA0092 | Jones, P. G.; Thöne, C. | μ-[Bis(diphenylphosphino)methane]-bis[pentafluorophenylgold(I)] at 178 K | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1312 | 1314 | 10.1107/S0108270191014518 | 0.71069 | monoclinic | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Jones, P. G.; Thöne, C.
μ-[Bis(diphenylphosphino)methane]-bis[pentafluorophenylgold(I)] at 178 K
Acta Crystallographica Section C
48(7)
(1992)
1312-1314 | 208,377 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-06-14 15:53:24 +0300 (Thu, 14 Jun 2018) $
#$Revision: 208377 $
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2,000,785 | 8.5402 | 0.0014 | 10.0286 | 0.0016 | 10.584 | 0.002 | 110.221 | 0.01 | 95.476 | 0.01 | 93.42 | 0.012 | 842.6 | 0.3 | null | null | null | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C26 H28 Ag2 Cu I4 N4 O2 - | - C26 H28 Ag2 Cu I4 N4 O2 - | - C26 H28 Ag2 Cu I4 N4 O2 - | 1 | 0.5 | HA0094 | Jones, P. G. | Bis[1,1-di(2-pyridyl)ethyl methyl ether-<i>N</i>,<i>N</i>',<i>O</i>]copper(II) di-μ-iodo-bis[iodoargentate(I)] | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1314 | 1315 | 10.1107/S0108270191014506 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Jones, P. G.
Bis[1,1-di(2-pyridyl)ethyl methyl ether-<i>N</i>,<i>N</i>',<i>O</i>]copper(II) di-μ-iodo-bis[iodoargentate(I)]
Acta Crystallographica Section C
48(7)
(1992)
1314-1315 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/07/2000785.cif $
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2,000,786 | 10.2 | 0.02 | 13.55 | 0.04 | 7.98 | 0.01 | 90.7 | 0.2 | 99.7 | 0.2 | 105.1 | 0.2 | 1,048 | 4 | null | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C21 H16 Cl Cu N5 O5 - | - C21 H16 Cl Cu N5 O5 - | - C42 H32 Cl2 Cu2 N10 O10 - | 2 | 1 | AL0480 | McAuliffe, C. A.; Pritchard, R. G.; Bermejo, M. R.; Garcia-Vazquez, A.; Macias, A.; Sanmartín, J.; Romero, J.; Sousa, A. | Bis(2,2'-bipyridine)isocyanatocopper(II) perchlorate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1316 | 1317 | 10.1107/S010827019101449X | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | McAuliffe, C. A.; Pritchard, R. G.; Bermejo, M. R.; Garcia-Vazquez, A.; Macias, A.; Sanmartín, J.; Romero, J.; Sousa, A.
Bis(2,2'-bipyridine)isocyanatocopper(II) perchlorate
Acta Crystallographica Section C
48(7)
(1992)
1316-1317 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$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/2/00/07/2000786.cif $
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7,205,779 | 26.982 | 0.008 | 7.503 | 0.002 | 15.853 | 0.004 | 90 | null | 109.316 | 0.007 | 90 | null | 3,028.7 | 1.4 | 296 | 2 | 296 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | - C12 H9 Cu2.5 N4 O10 - | - C12 H9 Cu2.5 N4 O10 - | - C96 H72 Cu20 N32 O80 - | 8 | 1 | Yang, En-Cui; Yang, You-Li; Liu, Zhong-Yi; Liu, Kai-Sheng; Wu, Xiao-Yun; Zhao, Xiao-Jun | Two unique antiferromagnetic 3D frameworks with unusual CuII4 cluster and alternate CuII4 + CuII1 structural motif tuned by aromatic polycarboxylate coligand | CrystEngComm | 2,011 | 13 | 7 | 2667 | 10.1039/c0ce00764a | 0.71073 | MoKα | 0.0246 | 0.0227 | null | null | 0.0626 | 0.0637 | null | null | null | null | null | 1.062 | null | null | has coordinates | Yang, En-Cui; Yang, You-Li; Liu, Zhong-Yi; Liu, Kai-Sheng; Wu, Xiao-Yun; Zhao, Xiao-Jun
Two unique antiferromagnetic 3D frameworks with unusual CuII4 cluster and alternate CuII4 + CuII1 structural motif tuned by aromatic polycarboxylate coligand
CrystEngComm
13(7)
(2011)
2667 | 176,453 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
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2,000,787 | 11.268 | 0.003 | 12.815 | 0.003 | 13.72 | 0.004 | 107.37 | 0.01 | 98.15 | 0.02 | 110.42 | 0.01 | 1,703.7 | 0.8 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C17 H22 N5 O2 - | - C17 H22 N5 O1.5 - | - C68 H88 N20 O6 - | 4 | 2 | PA0256 | Dupont, L.; Englebert, S.; Dideberg, O.; Liégeois, J. F.; Delarge, J. | Structure du 6-(4-méthylpipérazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,4]benzodiazépine 1,5-hydrate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1322 | 1324 | 10.1107/S0108270191013744 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Dupont, L.; Englebert, S.; Dideberg, O.; Liégeois, J. F.; Delarge, J.
Structure du 6-(4-méthylpipérazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,4]benzodiazépine 1,5-hydrate
Acta Crystallographica Section C
48(7)
(1992)
1322-1324 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,000,788 | 5.63 | 0.001 | 9.341 | 0.002 | 15.531 | 0.003 | 90 | null | 98.4 | 0.01 | 90 | null | 808 | 0.3 | null | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | - C11 H8 O2 - | - C11 H8 O2 - | - C44 H32 O8 - | 4 | 1 | AL0517 | Maniukiewicz, W.; Bukowska-Strzyżewska, M. | Structure of 2-hydroxy-1-naphthaldehyde | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1324 | 1326 | 10.1107/S0108270191013628 | 1.54178 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Maniukiewicz, W.; Bukowska-Strzyżewska, M.
Structure of 2-hydroxy-1-naphthaldehyde
Acta Crystallographica Section C
48(7)
(1992)
1324-1326 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,789 | 9.149 | 0.002 | 10.934 | 0.001 | 12.064 | 0.001 | 90 | null | 93.14 | 0.01 | 90 | null | 1,205 | 0.3 | null | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | null | - C10 H18 N2 O3 - | - C10 H18 N2 O3 - | - C40 H72 N8 O12 - | 4 | 1 | AS0509 | Okabe, N.; Tatsumi, M.; Sasaki, Y. | Structure of <small>DL</small>-desthiobiotin | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1326 | 1327 | 10.1107/S010827019101380X | 1.54178 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Okabe, N.; Tatsumi, M.; Sasaki, Y.
Structure of <small>DL</small>-desthiobiotin
Acta Crystallographica Section C
48(7)
(1992)
1326-1327 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,790 | 12.301 | 0.003 | 13.3 | 0.004 | 10.817 | 0.003 | 90 | null | 110.94 | 0.02 | 90 | null | 1,652.8 | 0.8 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C16 H14 Cl N3 O5 - | - C16 H14 Cl N3 O5 - | - C64 H56 Cl4 N12 O20 - | 4 | 1 | CR0377 | Boggess, R. K. | Monoprotonated perchlorate salt of tris(2-pyridyl)methanol | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1327 | 1329 | 10.1107/S0108270191013860 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Boggess, R. K.
Monoprotonated perchlorate salt of tris(2-pyridyl)methanol
Acta Crystallographica Section C
48(7)
(1992)
1327-1329 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,791 | 10.936 | 0.002 | 8.846 | 0.001 | 14.6 | 0.003 | 89.08 | 0.02 | 105.16 | 0.02 | 100.12 | 0.02 | 1,341.4 | 0.4 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C30 H33 N3 O5 - | - C30 H33 N3 O5 - | - C60 H66 N6 O10 - | 2 | 1 | PA0252 | Theobald, F.; Rodier, N.; Moustaid, K.; Nguyen Dinh An; Laude, B. | Structure of ethyl 1-<i>p</i>-anisyl-7,8-dimethoxy-4,5-dimethyl-3-phenyl-3a,4,5,9b-tetrahydropyrazolo[3,4-<i>c</i>]isoquinoline-3a-carboxylate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1329 | 1331 | 10.1107/S0108270191013719 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Theobald, F.; Rodier, N.; Moustaid, K.; Nguyen Dinh An; Laude, B.
Structure of ethyl 1-<i>p</i>-anisyl-7,8-dimethoxy-4,5-dimethyl-3-phenyl-3a,4,5,9b-tetrahydropyrazolo[3,4-<i>c</i>]isoquinoline-3a-carboxylate
Acta Crystallographica Section C
48(7)
(1992)
1329-1331 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
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7,205,778 | 9.824 | 0.005 | 10.017 | 0.006 | 11.36 | 0.007 | 111.68 | 0.02 | 96.45 | 0.02 | 94.56 | 0.02 | 1,023.3 | 1 | 291 | 2 | 291 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C14 H14 Cu Mo3 N4 O9.5 - | - C14 H14 Cu Mo3 N4 O9.5 - | - C28 H28 Cu2 Mo6 N8 O19 - | 2 | 1 | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin | Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains | CrystEngComm | 2,011 | 13 | 10 | 3526 | 10.1039/c0ce00761g | 0.71073 | MoKα | 0.0384 | 0.0313 | null | null | 0.0777 | 0.0898 | null | null | null | null | null | 1.136 | null | null | has coordinates | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
CrystEngComm
13(10)
(2011)
3526 | 176,453 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,000,792 | 5.4732 | null | 8.6274 | null | 19.4255 | null | 90 | null | 90 | null | 90 | null | 917.262 | null | null | null | null | null | null | null | null | null | 5 | P b c 21 | P 2c -2b | 29 | N-benzylmethanesulfonamide | - C8 H11 N O2 S - | - C8 H11 N O2 S - | - C32 H44 N4 O8 S4 - | 4 | 1 | HA0085 | Elmore, D. T.; Jones, J. H.; Raissi, M.; Prout, K. | <i>N</i>-Benzylmethanesulfonamide | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1331 | 1333 | 10.1107/S0108270191013987 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Elmore, D. T.; Jones, J. H.; Raissi, M.; Prout, K.
<i>N</i>-Benzylmethanesulfonamide
Acta Crystallographica Section C
48(7)
(1992)
1331-1333 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,793 | 9.203 | 0.003 | 9.81 | 0.03 | 12.705 | 0.006 | 90 | null | 90 | null | 90 | null | 1,147 | 4 | null | null | null | null | null | null | null | null | 3 | P b c a | null | - C10 H2 F12 - | - C10 H2 F12 - | - C40 H8 F48 - | 4 | 0.5 | ST0561 | Lynch, V. M.; Kampa, J. J.; Lagow, R. J.; Davis, B. E. | Structure of 1,2,4,5-tetrakis(trifluoromethyl)benzene | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1339 | 1341 | 10.1107/S0108270191013963 | 0.7107 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Lynch, V. M.; Kampa, J. J.; Lagow, R. J.; Davis, B. E.
Structure of 1,2,4,5-tetrakis(trifluoromethyl)benzene
Acta Crystallographica Section C
48(7)
(1992)
1339-1341 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,794 | 20.301 | 0.005 | 8.952 | 0.002 | 14.707 | 0.006 | 90 | null | 90 | null | 90 | null | 2,672.8 | 1.4 | null | null | null | null | null | null | null | null | 4 | P b c a | -P 2ac 2ab | null | - C12 H16 O5 S - | - C12 H16 O5 S - | - C96 H128 O40 S8 - | 8 | 1 | AB0261 | Frydenvang, K.; Jensen, B. | Structure of <i>cis</i>-2-methyl-4-tosyloxymethyl-1,3-dioxolane | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1341 | 1343 | 10.1107/S0108270191014622 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Frydenvang, K.; Jensen, B.
Structure of <i>cis</i>-2-methyl-4-tosyloxymethyl-1,3-dioxolane
Acta Crystallographica Section C
48(7)
(1992)
1341-1343 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,795 | 6.7895 | 0.0009 | 22.054 | 0.002 | 9.713 | 0.001 | 90 | null | 103.5 | 0.01 | 90 | null | 1,414.2 | 0.3 | null | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C11 H16 N4 O8 - | - C11 H16 N4 O8 - | - C44 H64 N16 O32 - | 4 | 1 | AB0260 | Frydenvang, K.; Jensen, B.; Nielsen, K. | Structure of choline picrate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1343 | 1345 | 10.1107/S0108270191014610 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Frydenvang, K.; Jensen, B.; Nielsen, K.
Structure of choline picrate
Acta Crystallographica Section C
48(7)
(1992)
1343-1345 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
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7,205,777 | 17.4554 | 0.0007 | 19.3865 | 0.0008 | 25.0002 | 0.0011 | 90 | null | 105.521 | 0.001 | 90 | null | 8,151.5 | 0.6 | 296 | 2 | 296 | 2 | null | null | null | null | 7 | C 1 2/c 1 | -C 2yc | 15 | - C56 H56 Cu4 Ge Mo12 N16 O40 - | - C56 H56 Cu4 Ge Mo12 N16 O40 - | - C224 H224 Cu16 Ge4 Mo48 N64 O160 - | 4 | 0.5 | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin | Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains | CrystEngComm | 2,011 | 13 | 10 | 3526 | 10.1039/c0ce00761g | 0.71073 | MoKα | 0.0781 | 0.0575 | null | null | 0.1301 | 0.1442 | null | null | null | null | null | 1.014 | null | null | has coordinates | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
CrystEngComm
13(10)
(2011)
3526 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
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2,000,796 | 15.603 | 0.003 | 13.7397 | 0.0006 | 23.717 | 0.005 | 90 | null | 90.28 | 0.015 | 90 | null | 5,084.4 | 1.5 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C17 H15 Cl10 N3 O2 - | - C17 H15 Cl10 N3 O2 - | - C136 H120 Cl80 N24 O16 - | 8 | 2 | GE0296 | Kanters, J. A.; ter Horst, E. H.; Grech, E. | Structure of [<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium(1+) pentachlorophenolate(1-) pentachlorophenol]~2~ | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1345 | 1347 | 10.1107/S010827019101435X | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kanters, J. A.; ter Horst, E. H.; Grech, E.
Structure of [<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium(1+) pentachlorophenolate(1-) pentachlorophenol]~2~
Acta Crystallographica Section C
48(7)
(1992)
1345-1347 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,797 | 7.825 | 0.001 | 14.254 | 0.001 | 18.91 | 0.002 | 90 | null | 90 | null | 90 | null | 2,109.2 | 0.4 | 293 | null | 293 | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | ent-3α,11b-Diacetoxy-2β-hydroxy-16-oxo-17,20-dinor-9α,15α- cyclogibberell- 1(10)-ene-7,19-dioic Acid 7-Methyl Ester 19,2-Lactone | - C23 H24 O9 - | - C23 H24 O9 - | - C92 H96 O36 - | 4 | 1 | HL1000 | Furber, M.; Mander, L. N.; Patrick, G. L.; Willis, A. C. | A 9,5-cyclogibberellin formed from a bromogibberellin-16-one derivative | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1348 | 1350 | 10.1107/S0108270192003767 | 0.71069 | MoKαradiation | 0.059 | 0.04 | null | 0.056 | 0.048 | null | null | null | 1.352 | 1.419 | 1.419 | null | null | null | has coordinates | Furber, M.; Mander, L. N.; Patrick, G. L.; Willis, A. C.
A 9,5-cyclogibberellin formed from a bromogibberellin-16-one derivative
Acta Crystallographica Section C
48(7)
(1992)
1348-1350 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,000,798 | 6.292 | 0.001 | 12.329 | 0.001 | 9.233 | 0.001 | 90 | null | 105.91 | 0.01 | 90 | null | 688.8 | 0.15 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | null | - F2 H20 N2 Ni O12 P2 - | - F2 H20 N2 Ni O12 P2 - | - F4 H40 N4 Ni2 O24 P4 - | 2 | 0.5 | AL1003 | Berraho, M.; R'Kha, C.; Vegas, A.; Rafiq, M. | Structure of Ni(H~2~O)~6~(NH~4~)~2~(PO~3~F)~2~ | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1350 | 1352 | 10.1107/S0108270192003044 | 0.7107 | MoKα | null | 0.03 | null | null | 0.034 | null | null | null | null | 0.996 | 0.996 | null | null | null | has coordinates | Berraho, M.; R'Kha, C.; Vegas, A.; Rafiq, M.
Structure of Ni(H~2~O)~6~(NH~4~)~2~(PO~3~F)~2~
Acta Crystallographica Section C
48(7)
(1992)
1350-1352 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,799 | 8.767 | 0.001 | 7.117 | 0.002 | 7.26 | 0.002 | 90 | null | 110.23 | 0.02 | 90 | null | 425.04 | 0.18 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 n 1 | P -2yac | 7 | (±)-cis-6-Acetylamino-5-hydroxy-1,3-dioxepane | - C7 H13 N O4 - | - C7 H13 N O4 - | - C14 H26 N2 O8 - | 2 | 1 | AB1006 | Vinković, M.; Dumić, M.; Kamenar, B. | (±)-<i>cis</i>-6-Acetylamino-5-hydroxy-1,3-dioxepane | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1352 | 1354 | 10.1107/S0108270192003755 | 0.7101 | MoKα | 0.036 | 0.032 | null | 0.045 | 0.041 | null | null | null | 0.7691 | 0.7693 | 0.7693 | null | null | null | has coordinates | Vinković, M.; Dumić, M.; Kamenar, B.
(±)-<i>cis</i>-6-Acetylamino-5-hydroxy-1,3-dioxepane
Acta Crystallographica Section C
48(7)
(1992)
1352-1354 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
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7,205,776 | 17.455 | 0.004 | 19.421 | 0.004 | 25.063 | 0.005 | 90 | null | 105.5 | 0.03 | 90 | null | 8,187 | 3 | 291 | 2 | 291 | 2 | null | null | null | null | 7 | C 1 2/c 1 | -C 2yc | 15 | - C56 H56 Cu4 N16 O40 Si W12 - | - C56 H56 Cu4 N16 O40 Si W12 - | - C224 H224 Cu16 N64 O160 Si4 W48 - | 4 | 0.5 | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin | Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains | CrystEngComm | 2,011 | 13 | 10 | 3526 | 10.1039/c0ce00761g | 0.71073 | MoKα | 0.0734 | 0.0654 | null | null | 0.1336 | 0.1371 | null | null | null | null | null | 1.195 | null | null | has coordinates | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
CrystEngComm
13(10)
(2011)
3526 | 180,388 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,000,800 | 8.86 | 0.008 | 11.007 | 0.002 | 16.316 | 0.004 | 90 | null | 90 | null | 90 | null | 1,591.2 | 1.5 | 293 | null | null | null | null | null | null | null | 5 | P n n 2 | P 2 -2n | null | - C14 H11 Fe N2 O10 - | - C14 H11 Fe N2 O10 - | - C56 H44 Fe4 N8 O40 - | 4 | 1 | DU1001 | Cousson, A.; Nectoux, F.; Rizkalla, E. N. | Structure of bis(dipicolinato)ferrate(III) dihydrate | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1354 | 1357 | 10.1107/S0108270192002877 | 0.71069 | MoKα | null | 0.041 | null | null | 0.04 | null | null | null | null | 2.15 | 2.15 | null | null | null | has coordinates | Cousson, A.; Nectoux, F.; Rizkalla, E. N.
Structure of bis(dipicolinato)ferrate(III) dihydrate
Acta Crystallographica Section C
48(7)
(1992)
1354-1357 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,000,801 | 5.135 | 0.001 | 5.135 | 0.001 | 33.882 | 0.005 | 90 | null | 90 | null | 90 | null | 893.4 | 0.4 | 293 | null | null | null | null | null | null | null | 5 | I 41/a | -I 4ad | null | - As Ca2 O12 W2 Y - | - As Ca2 O12 W2 Y - | - As4 Ca8 O48 W8 Y4 - | 4 | null | NA1005 | Demartin, F.; Gramaccioli, C. M.; Pilati, T. | Structure of a new natural tungstate arsenate, [Ca~2~Y(AsO~4~)(WO~4~)~2~], structurally related to scheelite | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1357 | 1359 | 10.1107/S0108270192003688 | 0.71073 | MoKα | null | 0.024 | null | null | 0.027 | null | null | null | null | 1.104 | 1.104 | null | null | null | has coordinates | Demartin, F.; Gramaccioli, C. M.; Pilati, T.
Structure of a new natural tungstate arsenate, [Ca~2~Y(AsO~4~)(WO~4~)~2~], structurally related to scheelite
Acta Crystallographica Section C
48(7)
(1992)
1357-1359 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,000,802 | 10.928 | 0.004 | 37.398 | 0.004 | 6.139 | 0.004 | 90 | null | 90 | null | 90 | null | 2,508.9 | 1.9 | 297 | null | 297 | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | 16-(p-butoxybenzylidene)androsta-1,4-diene-3,17-dione | - C30 H36 O3 - | - C30 H36 O3 - | - C120 H144 O12 - | 4 | 1 | HL1004 | Ogawa, K.; Yoshimura, S.; Kaji, M.; Kagawa, H.; Kakuta, A. | 16-(<i>p</i>-Butoxybenzylidene)androsta-1,4-diene-3,17-dione | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1359 | 1361 | 10.1107/S0108270192003925 | 1.54184 | 0.057 | 0.05 | null | 0.059 | 0.058 | null | null | null | 2.441 | 2.58 | 2.58 | null | null | null | has coordinates | Ogawa, K.; Yoshimura, S.; Kaji, M.; Kagawa, H.; Kakuta, A.
16-(<i>p</i>-Butoxybenzylidene)androsta-1,4-diene-3,17-dione
Acta Crystallographica Section C
48(7)
(1992)
1359-1361 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000802.cif $
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2,000,803 | 19.72 | 0.009 | 7.703 | 0.003 | 7.753 | 0.003 | 90 | null | 96.57 | 0.04 | 90 | null | 1,170 | 0.8 | 178 | null | null | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | null | - C4 Ag2 N4 S4 Zn - | - C4 Ag2 N4 S4 Zn - | - C16 Ag8 N16 S16 Zn4 - | 4 | 0.5 | HA1006 | Jones, P. G.; Bembenek, E. | Redetermination of the structure of zinc disilver(I) tetrathiocyanate (at 178 K) | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1361 | 1362 | 10.1107/S0108270192003986 | 0.71069 | MoKα | null | 0.026 | null | null | 0.03 | null | null | null | null | 1.6 | 1.6 | null | null | null | has coordinates | Jones, P. G.; Bembenek, E.
Redetermination of the structure of zinc disilver(I) tetrathiocyanate (at 178 K)
Acta Crystallographica Section C
48(7)
(1992)
1361-1362 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
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2,000,804 | 28.795 | 0.003 | 8.887 | 0.001 | 12.139 | 0.001 | 90 | null | 103.17 | 0.01 | 90 | null | 3,024.7 | 0.5 | 293 | null | 293 | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | 2-(tert-butyl)-cis-5-(p-chlorophenylthio)-trans-5-methyl-1,3-dioxolan-4-one | - C14 H17 Cl O3 S - | - C14 H17 Cl O3 S - | - C112 H136 Cl8 O24 S8 - | 8 | 1 | HL1010 | Beckwith, A. L. J.; Chai, C. L. L.; Willis, A. C. | 2-(<i>tert</i>-Butyl)-<i>cis</i>-5-(<i>p</i>-chlorophenylthio)-<i>trans</i>-5-methyl-1,3-dioxolan-4-one | Acta Crystallographica Section C | 1,992 | 48 | 7 | 1362 | 1364 | 10.1107/S0108270192004165 | 0.71069 | molybdenumKα | 0.061 | 0.031 | null | 0.047 | 0.039 | null | null | null | 1.258 | 1.311 | 1.311 | null | null | null | has coordinates | Beckwith, A. L. J.; Chai, C. L. L.; Willis, A. C.
2-(<i>tert</i>-Butyl)-<i>cis</i>-5-(<i>p</i>-chlorophenylthio)-<i>trans</i>-5-methyl-1,3-dioxolan-4-one
Acta Crystallographica Section C
48(7)
(1992)
1362-1364 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$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/2/00/08/2000804.cif $
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7,205,775 | 17.473 | 0.003 | 19.379 | 0.004 | 24.951 | 0.005 | 90 | null | 105.36 | 0.03 | 90 | null | 8,147 | 3 | 291 | 2 | 291 | 2 | null | null | null | null | 7 | C 1 2/c 1 | -C 2yc | 15 | - C56 H56 Cu4 Mo12 N16 O40 Si - | - C56 H56 Cu4 Mo12 N16 O40 Si - | - C224 H224 Cu16 Mo48 N64 O160 Si4 - | 4 | 0.5 | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin | Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains | CrystEngComm | 2,011 | 13 | 10 | 3526 | 10.1039/c0ce00761g | 0.71073 | MoKα | 0.0725 | 0.0696 | null | null | 0.172 | 0.1739 | null | null | null | null | null | 1.093 | null | null | has coordinates | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
CrystEngComm
13(10)
(2011)
3526 | 180,388 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-26 17:20:13 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180388 $
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2,000,805 | 7.651 | 0.002 | 21.79 | 0.01 | 6.689 | 0.002 | 90 | null | 113.85 | 0.03 | 90 | null | 1,020 | 1 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - H16 N2 O13 P2 Te - | - H13 N2 O10 P2 Te0.5 - | - H52 N8 O40 P8 Te2 - | 4 | 1 | PA0258 | Averbuch-Pouchot, M. T.; Durif, A. | Structure of an adduct between diammonium dihydrogendiphoshate and telluric acid: (NH~4~)~2~H~2~P~2~O~7~.Te(OH)~6~ | Acta Crystallographica Section C | 1,992 | 48 | 6 | 973 | 975 | 10.1107/S0108270191013604 | 0.5608 | Ag | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Averbuch-Pouchot, M. T.; Durif, A.
Structure of an adduct between diammonium dihydrogendiphoshate and telluric acid: (NH~4~)~2~H~2~P~2~O~7~.Te(OH)~6~
Acta Crystallographica Section C
48(6)
(1992)
973-975 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
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2,000,806 | 5.616 | 0.002 | 10.062 | 0.001 | 8.727 | 0.001 | 90 | null | 90.9 | 0.02 | 90 | null | 493.09 | 0.19 | null | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - Ba O6 P V - | - Ba O6 P V - | - Ba4 O24 P4 V4 - | 4 | 1 | BR0009 | Kang, H. Y.; Wang, S. L.; Lii, K. H. | Hydrothermal synthesis and structures of two layered dioxovanadium(V) phosphates <i>A</i>(VO~2~)PO~4~ (<i>A</i> = Ba, Sr) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 975 | 978 | 10.1107/S0108270191014038 | 0.7093 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kang, H. Y.; Wang, S. L.; Lii, K. H.
Hydrothermal synthesis and structures of two layered dioxovanadium(V) phosphates <i>A</i>(VO~2~)PO~4~ (<i>A</i> = Ba, Sr)
Acta Crystallographica Section C
48(6)
(1992)
975-978 | 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/2/00/08/2000806.cif $
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2,000,807 | 5.43 | 0.001 | 9.846 | 0.002 | 8.517 | 0.002 | 90 | null | 90.6 | 0.02 | 90 | null | 455.33 | 0.16 | null | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - O6 P Sr V - | - O6 P Sr V - | - O24 P4 Sr4 V4 - | 4 | 1 | BR0009 | Kang, H. Y.; Wang, S. L.; Lii, K. H. | Hydrothermal synthesis and structures of two layered dioxovanadium(V) phosphates <i>A</i>(VO~2~)PO~4~ (<i>A</i> = Ba, Sr) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 975 | 978 | 10.1107/S0108270191014038 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kang, H. Y.; Wang, S. L.; Lii, K. H.
Hydrothermal synthesis and structures of two layered dioxovanadium(V) phosphates <i>A</i>(VO~2~)PO~4~ (<i>A</i> = Ba, Sr)
Acta Crystallographica Section C
48(6)
(1992)
975-978 | 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/2/00/08/2000807.cif $
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7,205,774 | 19.675 | 0.002 | 36.612 | 0.0013 | 27.69 | 0.003 | 90 | null | 134.453 | 0.019 | 90 | null | 14,238 | 5 | 291 | 2 | 291 | 2 | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | - C42 H42 Cu3 Mo12 N12 O40 P - | - C42 H42 Cu3 Mo12 N12 O40 P - | - C336 H336 Cu24 Mo96 N96 O320 P8 - | 8 | 2 | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin | Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains | CrystEngComm | 2,011 | 13 | 10 | 3526 | 10.1039/c0ce00761g | 0.71073 | MoKα | 0.0789 | 0.0489 | null | null | 0.0931 | 0.1049 | null | null | null | null | null | 1.027 | null | null | has coordinates | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
CrystEngComm
13(10)
(2011)
3526 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301863 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/57/7205774.cif $
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2,000,808 | 12.45 | 0.002 | 12.727 | 0.003 | 12.694 | 0.002 | 90 | null | 97.99 | 0.01 | 90 | null | 1,991.9 | 0.7 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - As2 Ba3 H14 O7 S8 - | - As2 Ba3 H14 O7 S8 - | - As8 Ba12 H56 O28 S32 - | 4 | 1 | SE0081 | Mereiter, K.; Preisinger, A. | Structure of Ba~3~(AsS~4~)~2~.7H~2~O at 125 K | Acta Crystallographica Section C | 1,992 | 48 | 6 | 984 | 987 | 10.1107/S0108270191013938 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Mereiter, K.; Preisinger, A.
Structure of Ba~3~(AsS~4~)~2~.7H~2~O at 125 K
Acta Crystallographica Section C
48(6)
(1992)
984-987 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000808.cif $
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2,000,809 | 11.996 | 0.005 | 15.298 | 0.006 | 16.508 | 0.009 | 90 | null | 105.4 | 0.03 | 90 | null | 2,921 | 2 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C32 H28 Cr O4 P2 - | - C32 H28 Cr O4 P2 - | - C128 H112 Cr4 O16 P8 - | 4 | 1 | AS0545 | Ueng, C.-H.; Shih, G.-Y. | Structures of [1,4-bis(diphenylphosphino)butane]tetracarbonylchromium(0) (1) and [1,4-bis(diphenylphosphino)butane]tetracarbonyltungsten(0) (2) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 988 | 991 | 10.1107/S0108270191012404 | 0.7093 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Ueng, C.-H.; Shih, G.-Y.
Structures of [1,4-bis(diphenylphosphino)butane]tetracarbonylchromium(0) (1) and [1,4-bis(diphenylphosphino)butane]tetracarbonyltungsten(0) (2)
Acta Crystallographica Section C
48(6)
(1992)
988-991 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000809.cif $
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2,000,810 | 12.055 | 0.001 | 15.352 | 0.005 | 16.544 | 0.004 | 90 | null | 104.68 | 0.02 | 90 | null | 2,961.8 | 1.3 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C32 H28 O4 P2 W - | - C32 H28 O4 P2 W - | - C128 H112 O16 P8 W4 - | 4 | 1 | AS0545 | Ueng, C.-H.; Shih, G.-Y. | Structures of [1,4-bis(diphenylphosphino)butane]tetracarbonylchromium(0) (1) and [1,4-bis(diphenylphosphino)butane]tetracarbonyltungsten(0) (2) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 988 | 991 | 10.1107/S0108270191012404 | 0.7093 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Ueng, C.-H.; Shih, G.-Y.
Structures of [1,4-bis(diphenylphosphino)butane]tetracarbonylchromium(0) (1) and [1,4-bis(diphenylphosphino)butane]tetracarbonyltungsten(0) (2)
Acta Crystallographica Section C
48(6)
(1992)
988-991 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000810.cif $
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2,000,811 | 5.161 | 0.002 | 12.251 | 0.004 | 11.266 | 0.003 | 90 | null | 94.87 | 0.02 | 90 | null | 709.7 | 0.4 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C4 H11 Ge N O4 - | - C4 H11 Ge N O4 - | - C16 H44 Ge4 N4 O16 - | 4 | 1 | AS0538 | Chiang, H.-C.; Lin, S.-M.; Ueng, C.-H. | Synthesis and structure of dihydroxo(η^3^-2,2'-iminodiethoxo)germanium(IV) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 991 | 993 | 10.1107/S0108270191012398 | 0.7093 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Chiang, H.-C.; Lin, S.-M.; Ueng, C.-H.
Synthesis and structure of dihydroxo(η^3^-2,2'-iminodiethoxo)germanium(IV)
Acta Crystallographica Section C
48(6)
(1992)
991-993 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000811.cif $
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7,205,773 | 16.504 | 0.003 | 25.01 | 0.005 | 26.843 | 0.009 | 90 | null | 116.46 | 0.02 | 90 | null | 9,919 | 5 | 291 | 2 | 291 | 2 | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | - C70 H72 B Cu5 N20 O41 W12 - | - C70 H72 B Cu5 N20 O41 W12 - | - C280 H288 B4 Cu20 N80 O164 W48 - | 4 | 1 | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin | Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains | CrystEngComm | 2,011 | 13 | 10 | 3526 | 10.1039/c0ce00761g | 0.71073 | MoKα | 0.0712 | 0.0441 | null | null | 0.0806 | 0.0891 | null | null | null | null | null | 1.022 | null | null | has coordinates | Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
CrystEngComm
13(10)
(2011)
3526 | 180,388 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-26 17:20:13 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180388 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/57/7205773.cif $
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2,000,812 | 12.583 | 0.007 | 12.667 | 0.008 | 13.08 | 0.008 | 76.59 | 0.04 | 86.72 | 0.04 | 79.34 | 0.04 | 1,993 | 2 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C78 H72 I6 In2 P6 - | - C78 H72 I6 In2 P6 - | - C78 H72 I6 In2 P6 - | 1 | 0.5 | LI0104 | Degnan, I. A.; Alcock, N. W.; Roe, S. M.; Wallbridge, M. G. H. | Structures of adducts formed by indium(III) halides and phosphine ligands: tris[1,2-bis(diphenylphosphino)ethane]bis[triiodoindium(III)] and trichlorobis(trimethylphosphine)indium(III) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 995 | 999 | 10.1107/S0108270191013033 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Degnan, I. A.; Alcock, N. W.; Roe, S. M.; Wallbridge, M. G. H.
Structures of adducts formed by indium(III) halides and phosphine ligands: tris[1,2-bis(diphenylphosphino)ethane]bis[triiodoindium(III)] and trichlorobis(trimethylphosphine)indium(III)
Acta Crystallographica Section C
48(6)
(1992)
995-999 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,000,813 | 10.418 | 0.008 | 10.769 | 0.009 | 13.808 | 0.009 | 90 | null | 90 | null | 90 | null | 1,549 | 2 | null | null | null | null | null | null | null | null | 5 | P n m a | -P 2ac 2n | 62 | - C6 H18 Cl3 In P2 - | - C6 H18 Cl3 In P2 - | - C24 H72 Cl12 In4 P8 - | 4 | 0.5 | LI0104 | Degnan, I. A.; Alcock, N. W.; Roe, S. M.; Wallbridge, M. G. H. | Structures of adducts formed by indium(III) halides and phosphine ligands: tris[1,2-bis(diphenylphosphino)ethane]bis[triiodoindium(III)] and trichlorobis(trimethylphosphine)indium(III) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 995 | 999 | 10.1107/S0108270191013033 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Degnan, I. A.; Alcock, N. W.; Roe, S. M.; Wallbridge, M. G. H.
Structures of adducts formed by indium(III) halides and phosphine ligands: tris[1,2-bis(diphenylphosphino)ethane]bis[triiodoindium(III)] and trichlorobis(trimethylphosphine)indium(III)
Acta Crystallographica Section C
48(6)
(1992)
995-999 | 278,244 | 2022-09-28 | 13:56:22 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 16:56:03 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278244 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000813.cif $
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2,000,814 | 10.058 | 0.001 | 14.182 | 0.003 | 17.988 | 0.003 | 90 | null | 97.94 | 0.02 | 90 | null | 2,541.3 | 0.7 | null | null | null | null | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | null | - C20 H9 I N O9 P Ru3 - | - C20 H9 I N O9 P Ru3 - | - C80 H36 I4 N4 O36 P4 Ru12 - | 4 | 1 | PA0254 | Lugan, N.; Lavigne, G.; Bonnet, J.-J. | Structural characterization of 1,1,1,2,2,2,3,3,3-nonacarbonyl-1,2-μ-iodo-1,2,3-[μ~3~-(phenylpyridylphosphido)-μ-<i>P</i>,<i>N</i>]-<i>triangulo</i>-triruthenium | Acta Crystallographica Section C | 1,992 | 48 | 6 | 999 | 1002 | 10.1107/S010827019101260X | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Lugan, N.; Lavigne, G.; Bonnet, J.-J.
Structural characterization of 1,1,1,2,2,2,3,3,3-nonacarbonyl-1,2-μ-iodo-1,2,3-[μ~3~-(phenylpyridylphosphido)-μ-<i>P</i>,<i>N</i>]-<i>triangulo</i>-triruthenium
Acta Crystallographica Section C
48(6)
(1992)
999-1002 | 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/2/00/08/2000814.cif $
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7,205,772 | 5.9666 | 0.0002 | 8.7396 | 0.0002 | 19.1354 | 0.0006 | 90 | null | 92.854 | 0.002 | 90 | null | 996.59 | 0.05 | 100 | 0.1 | 100 | 0.1 | null | null | null | null | synthesis as described | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C2 H7 N3 S - | - C2 H7 N3 S - | - C16 H56 N24 S8 - | 8 | 2 | Francuski, Bojana M.; Novaković, Sladjana B.; Bogdanović, Goran A. | Electronic features and hydrogen bonding capacity of the sulfur acceptor in thioureido-based compounds. Experimental charge density study of 4-methyl-3-thiosemicarbazide | CrystEngComm | 2,011 | 13 | 10 | 3580 | 10.1039/c0ce00760a | 0.71073 | MoKα | 0.0295 | 0.0178 | null | null | 0.0385 | 0.0199 | null | null | null | null | null | 0.817 | null | null | has coordinates | Francuski, Bojana M.; Novaković, Sladjana B.; Bogdanović, Goran A.
Electronic features and hydrogen bonding capacity of the sulfur acceptor in thioureido-based compounds. Experimental charge density study of 4-methyl-3-thiosemicarbazide
CrystEngComm
13(10)
(2011)
3580 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301863 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/57/7205772.cif $
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2,000,815 | 26.374 | 0.003 | 12.22 | 0.002 | 16.278 | 0.003 | 90 | null | 90 | null | 90 | null | 5,246.2 | 1.4 | null | null | null | null | null | null | null | null | 6 | F d d 2 | F 2 -2d | null | - C26 H26 Cl2 N2 O2 Zn - | - C32 H12 Cl2 N2 O2 Zn - | - C256 H96 Cl16 N16 O16 Zn8 - | 8 | 0.5 | BX0556 | Hajjem, B.; Kallel, A.; Svoboda, I.; Sakurai, J. | Structure of di(5-β-methylallyl-2-phenyl-1,3-oxazole)zinc(II) dichloride | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1002 | 1004 | 10.1107/S0108270191013343 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Hajjem, B.; Kallel, A.; Svoboda, I.; Sakurai, J.
Structure of di(5-β-methylallyl-2-phenyl-1,3-oxazole)zinc(II) dichloride
Acta Crystallographica Section C
48(6)
(1992)
1002-1004 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
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2,000,816 | 7.761 | 0.005 | 20.578 | 0.01 | 15.634 | 0.011 | 90 | null | 103.1 | 0.06 | 90 | null | 2,432 | 3 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C13 H12 Mn N O2 - | - C13 H12 Mn N O2 - | - C104 H96 Mn8 N8 O16 - | 8 | 2 | AB0251 | Crocock, B.; Long, C.; Howie, R. A. | The synthesis and structure of the pyridine-substituted derivative of tricarbonyl(η^5^-methylcyclopentadienyl)manganese(I) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1004 | 1007 | 10.1107/S0108270191013161 | 0.710692 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Crocock, B.; Long, C.; Howie, R. A.
The synthesis and structure of the pyridine-substituted derivative of tricarbonyl(η^5^-methylcyclopentadienyl)manganese(I)
Acta Crystallographica Section C
48(6)
(1992)
1004-1007 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
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2,000,817 | 7.929 | 0.002 | 8.716 | 0.003 | 10.914 | 0.003 | 98.77 | 0.02 | 90.3 | 0.02 | 105.79 | 0.02 | 716.4 | 0.4 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C6 H20 N O13 V - | - C6 H20 N O13 V - | - C12 H40 N2 O26 V2 - | 2 | 1 | AS0562 | Okamoto, K.; Hidaka, J.; Fukagawa, M.; Kanamori, K. | Structure of triaqua(nitrilotriacetato)vanadium(III) tetrahydrate | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1025 | 1027 | 10.1107/S010827019101377X | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Okamoto, K.; Hidaka, J.; Fukagawa, M.; Kanamori, K.
Structure of triaqua(nitrilotriacetato)vanadium(III) tetrahydrate
Acta Crystallographica Section C
48(6)
(1992)
1025-1027 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,818 | 14.332 | 0.003 | 16.592 | 0.003 | 17.42 | 0.003 | 90 | null | 90 | null | 90 | null | 4,142.4 | 1.3 | null | null | null | null | null | null | null | null | 6 | P b c a | null | - C10 H30 Cl2 O3 P4 Pd - | - C10 H30 Cl2 O3 P4 Pd - | - C80 H240 Cl16 O24 P32 Pd8 - | 8 | 1 | CR0282 | Davies, J. A.; Pinkerton, A. A.; Vilmer, M. | <i>cis</i>-Di[bis(dimethylphosphino)methane <i>P</i>-oxide-<i>P</i>']dichloropalladium(II) monohydrate | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1027 | 1029 | 10.1107/S0108270191013859 | 0.7093 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Davies, J. A.; Pinkerton, A. A.; Vilmer, M.
<i>cis</i>-Di[bis(dimethylphosphino)methane <i>P</i>-oxide-<i>P</i>']dichloropalladium(II) monohydrate
Acta Crystallographica Section C
48(6)
(1992)
1027-1029 | 189,069 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-12-12 11:03:14 +0200 (Mon, 12 Dec 2016) $
#$Revision: 189069 $
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#-------------------------------------------------------------------... | ||||||||||||
7,205,771 | 28.971 | 0.0006 | 6.585 | 0.0001 | 23.0547 | 0.0005 | 90 | null | 102.386 | 0.001 | 90 | null | 4,295.87 | 0.15 | 173 | 2 | 173 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | (cyclododecylammonium).(adamantanecarboxylate) | - C23 H41 N O2 - | - C23 H41 N O2 - | - C184 H328 N8 O16 - | 8 | 1 | Lemmerer, Andreas | Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12 | CrystEngComm | 2,011 | 13 | 8 | 2849 | 10.1039/c0ce00749h | 0.71073 | MoKα | 0.0624 | 0.0438 | null | null | 0.1231 | 0.1569 | null | null | null | null | null | 0.644 | null | null | has coordinates,has disorder | Lemmerer, Andreas
Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12
CrystEngComm
13(8)
(2011)
2849 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301863 $
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2,000,819 | 12.082 | 0.001 | 8.965 | 0.001 | 22.888 | 0.002 | 90 | null | 91.25 | 0.01 | 90 | null | 2,478.5 | 0.4 | null | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C8 H24 Cl3 N4 Nd O22 - | - C8 Cl3 N4 Nd O37 - | - C32 Cl12 N16 Nd4 O148 - | 4 | 1 | KA0012 | Csöregh, I.; Huskowska, E.; Legendziewicz, J. | Structure of a neodymium diglycine complex, [Nd(Gly-Gly)~2~(H~2~O)~2~](ClO~4~)~3~.2H~2~O | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1030 | 1033 | 10.1107/S0108270191014257 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Csöregh, I.; Huskowska, E.; Legendziewicz, J.
Structure of a neodymium diglycine complex, [Nd(Gly-Gly)~2~(H~2~O)~2~](ClO~4~)~3~.2H~2~O
Acta Crystallographica Section C
48(6)
(1992)
1030-1033 | 278,324 | 2022-10-03 | 14:41:52 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/08/2000819.cif $
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2,000,820 | 16.58 | 0.03 | 8.34 | 0.01 | 24.35 | 0.03 | 90 | null | 91.2 | 0.2 | 90 | null | 3,366 | 8 | null | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | null | - C20 H22 O3 - | - C20 H22 O3 - | - C160 H176 O24 - | 8 | 2 | CR0353 | Robinson, P. D.; Meyers, C. Y.; Kolb, V. M.; Tunnell, J. L.; Ferrara, J. D. | Structure of the crystalline dimer of α-hydroxyisobutyrophenone: (<i>R</i>,<i>S</i>)-3,3,6,6-tetramethyl-1,4-diphenyl-2,5,7-trioxabicyclo[2.2.1]heptane | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1033 | 1036 | 10.1107/S0108270191012428 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Robinson, P. D.; Meyers, C. Y.; Kolb, V. M.; Tunnell, J. L.; Ferrara, J. D.
Structure of the crystalline dimer of α-hydroxyisobutyrophenone: (<i>R</i>,<i>S</i>)-3,3,6,6-tetramethyl-1,4-diphenyl-2,5,7-trioxabicyclo[2.2.1]heptane
Acta Crystallographica Section C
48(6)
(1992)
1033-1036 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$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/2/00/08/2000820.cif $
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2,000,821 | 13.49 | 0.003 | 7.734 | 0.002 | 8.211 | 0.003 | 90 | null | 97.6 | 0.04 | 90 | null | 849.1 | 0.4 | null | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | null | - C18 H22 N4 - | - C18 H22 N4 - | - C36 H44 N8 - | 2 | 0.5 | PA0236 | Bocelli, G.; Cantoni, A.; Tosi, G. | Structure of butanedione bis(methylphenylhydrazone) | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1041 | 1043 | 10.1107/S010827019101257X | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Bocelli, G.; Cantoni, A.; Tosi, G.
Structure of butanedione bis(methylphenylhydrazone)
Acta Crystallographica Section C
48(6)
(1992)
1041-1043 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,000,822 | 9.734 | 0.002 | 10.873 | 0.007 | 7.256 | 0.002 | 101.47 | 0.04 | 106.31 | 0.02 | 81.6 | 0.04 | 719 | 0.5 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C14 H15 Cl2 N S - | - C14 H15 Cl2 N S - | - C28 H30 Cl4 N2 S2 - | 2 | 1 | PA0247 | Enjalbert, R.; Galy, J.; Géhénot, A.; Rao, R. C.; Maire, G. | Structure of ticlopidine hydrochloride - a platelet antiaggregating agent | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1043 | 1045 | 10.1107/S0108270191012593 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Enjalbert, R.; Galy, J.; Géhénot, A.; Rao, R. C.; Maire, G.
Structure of ticlopidine hydrochloride - a platelet antiaggregating agent
Acta Crystallographica Section C
48(6)
(1992)
1043-1045 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$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/2/00/08/2000822.cif $
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7,205,770 | 6.4758 | 0.0003 | 11.2016 | 0.0006 | 24.5573 | 0.0014 | 90 | null | 93.217 | 0.004 | 90 | null | 1,778.56 | 0.16 | 173 | 2 | 173 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | (cyclooctylammonium).(adamantane carboxylate) | - C19 H33 N O2 - | - C19 H33 N O2 - | - C76 H132 N4 O8 - | 4 | 1 | Lemmerer, Andreas | Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12 | CrystEngComm | 2,011 | 13 | 8 | 2849 | 10.1039/c0ce00749h | 0.71073 | MoKα | 0.1684 | 0.065 | null | null | 0.1146 | 0.147 | null | null | null | null | null | 0.918 | null | null | has coordinates | Lemmerer, Andreas
Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12
CrystEngComm
13(8)
(2011)
2849 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301863 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/57/7205770.cif $
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2,000,823 | 7.659 | 0.001 | 12.741 | 0.001 | 15.095 | 0.001 | 90 | null | 90 | null | 90 | null | 1,473 | 0.2 | null | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C17 H17 N3 O2 - | - C17 H17 N3 O2 - | - C68 H68 N12 O8 - | 4 | 1 | LI0105 | Priya, V.; Shamala, N.; Viswamitra, M. A.; Senthil Kumar, U. P.; Jeyaraman, R. | Structure of <i>N</i>-nitroso-<i>r</i>-2,<i>c</i>-7-diphenylhexahydro-1,4-diazepin-5-one | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1048 | 1051 | 10.1107/S0108270191012982 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Priya, V.; Shamala, N.; Viswamitra, M. A.; Senthil Kumar, U. P.; Jeyaraman, R.
Structure of <i>N</i>-nitroso-<i>r</i>-2,<i>c</i>-7-diphenylhexahydro-1,4-diazepin-5-one
Acta Crystallographica Section C
48(6)
(1992)
1048-1051 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$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/2/00/08/2000823.cif $
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2,000,824 | 14.232 | 0.001 | 14.232 | 0.001 | 10.169 | 0.004 | 90 | null | 90 | null | 90 | null | 2,059.7 | 0.8 | null | null | null | null | null | null | null | null | 4 | P -4 21 c | P -4 2n | null | - C9 H11 N3 O3 - | - C9 H11 N3 O3 - | - C72 H88 N24 O24 - | 8 | 1 | AS0547 | Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N. | Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1051 | 1054 | 10.1107/S0108270191012908 | 1.5405 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N.
Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas
Acta Crystallographica Section C
48(6)
(1992)
1051-1054 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,000,825 | 13.854 | 0.001 | 9.071 | 0.001 | 11.808 | 0.004 | 90 | null | 92.14 | 0.01 | 90 | null | 1,482.9 | 0.5 | null | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | - C14 H21 N3 O2 - | - C14 H21 N3 O2 - | - C56 H84 N12 O8 - | 4 | 1 | AS0547 | Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N. | Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1051 | 1054 | 10.1107/S0108270191012908 | 1.5405 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N.
Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas
Acta Crystallographica Section C
48(6)
(1992)
1051-1054 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,000,826 | 12.639 | 0.001 | 10.185 | 0.001 | 7.851 | 0.004 | 90 | null | 96.92 | 0.01 | 90 | null | 1,003.3 | 0.5 | null | null | null | null | null | null | null | null | 4 | P 1 21 1 | null | - C22 H21 N3 O2 - | - C22 H21 N3 O2 - | - C44 H42 N6 O4 - | 2 | 1 | AS0547 | Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N. | Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1051 | 1054 | 10.1107/S0108270191012908 | 1.5405 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N.
Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas
Acta Crystallographica Section C
48(6)
(1992)
1051-1054 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,000,827 | 7.311 | 0.001 | 5.565 | 0.001 | 88.01 | 0.01 | 90 | null | 90 | null | 90 | null | 3,580.7 | 0.9 | null | null | null | null | null | null | null | null | 3 | P b c a | -P 2ac 2ab | null | - C18 H34 O2 - | - C18 H34 O2 - | - C144 H272 O16 - | 8 | 1 | AS0516 | Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M. | Structure of the low-melting phase of petroselinic acid | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1054 | 1057 | 10.1107/S0108270191012921 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.
Structure of the low-melting phase of petroselinic acid
Acta Crystallographica Section C
48(6)
(1992)
1054-1057 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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7,205,769 | 23.4749 | 0.001 | 6.4309 | 0.0002 | 21.8759 | 0.001 | 90 | null | 96.802 | 0.002 | 90 | null | 3,279.2 | 0.2 | 173 | 2 | 173 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | (cycloheptylammonium).(adamantane carboxylate) | - C18 H31 N O2 - | - C18 H31 N O2 - | - C144 H248 N8 O16 - | 8 | 1 | Lemmerer, Andreas | Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12 | CrystEngComm | 2,011 | 13 | 8 | 2849 | 10.1039/c0ce00749h | 0.71073 | MoKα | 0.0772 | 0.05 | null | null | 0.1099 | 0.1218 | null | null | null | null | null | 0.969 | null | null | has coordinates | Lemmerer, Andreas
Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12
CrystEngComm
13(8)
(2011)
2849 | 301,863 | 2025-08-22 | 13:07:26 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301863 $
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2,000,828 | 5.359 | 0.001 | 8.874 | 0.002 | 41.391 | 0.005 | 90.49 | 0.01 | 89.12 | 0.02 | 113.81 | 0.02 | 1,800.6 | 0.6 | null | null | null | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C18 H34 O2 - | - C18 H34 O2 - | - C72 H136 O8 - | 4 | 2 | AS0527 | Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M. | Structure of the high-melting phase of petroselinic acid | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1057 | 1060 | 10.1107/S0108270191013173 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.
Structure of the high-melting phase of petroselinic acid
Acta Crystallographica Section C
48(6)
(1992)
1057-1060 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,000,829 | 5.462 | 0.001 | 5.197 | 0.001 | 44.16 | 0.01 | 91.2 | 0.01 | 90.85 | 0.02 | 117.32 | 0.02 | 1,113 | 0.4 | null | null | null | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C22 H42 O2 - | - C22 H42 O2 - | - C44 H84 O4 - | 2 | 1 | AS0523 | Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M. | Structure of the γ~1~ phase of erucic acid | Acta Crystallographica Section C | 1,992 | 48 | 6 | 1060 | 1063 | 10.1107/S0108270191012994 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.
Structure of the γ~1~ phase of erucic acid
Acta Crystallographica Section C
48(6)
(1992)
1060-1063 | 301,791 | 2025-08-18 | 23:14:59 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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