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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,009,723 | 11.864 | 0.001 | 7.434 | 0.001 | 12.216 | 0.002 | 90 | null | 110.05 | 0.01 | 90 | null | 1,012.1 | 0.2 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 2-(p-aminophenyl)-1-methyl-5-nitroimidazole | - C10 H10 N4 O2 - | - C10 H10 N4 O2 - | - C40 H40 N16 O8 - | 4 | 1 | NA1071 | Olszak, Tomasz A.; Peeters, O.M.; Blaton, N.M.; De Ranter, C.J. | 1-Methyl-5-nitro-2-phenylimidazole and 2-(<i>p</i>-aminophenyl)-1-methyl-5-nitroimidazole | Acta Crystallographica Section C | 1,994 | 50 | 5 | 761 | 763 | 10.1107/S0108270193012375 | 0.71069 | MoKα | null | 0.037 | null | null | 0.04 | null | null | null | null | 0.9902 | 0.9902 | null | null | null | has coordinates | Olszak, Tomasz A.; Peeters, O.M.; Blaton, N.M.; De Ranter, C.J.
1-Methyl-5-nitro-2-phenylimidazole and 2-(<i>p</i>-aminophenyl)-1-methyl-5-nitroimidazole
Acta Crystallographica Section C
50(5)
(1994)
761-763 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,724 | 8.412 | 0.002 | 8.412 | 0.002 | 8.412 | 0.002 | 90 | null | 90 | null | 90 | null | 595.2 | 0.2 | 295 | 2 | null | null | null | null | null | null | 3 | I -4 3 m | I -4 2 3 | null | - Li3 Nb O4 - | - Li3 Nb O4 - | - Li24 Nb8 O32 - | 8 | 0.166667 | OH1036 | Ukei, K.; Suzuki, H.; Shishido, T.; Fukuda, T. | Li~3~NbO~4~ | Acta Crystallographica Section C | 1,994 | 50 | 5 | 655 | 656 | 10.1107/S010827019300890X | 0.71073 | MoKα | null | 0.031 | null | null | 0.045 | null | null | null | null | 9.85 | 9.85 | null | null | null | has coordinates | Ukei, K.; Suzuki, H.; Shishido, T.; Fukuda, T.
Li~3~NbO~4~
Acta Crystallographica Section C
50(5)
(1994)
655-656 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,725 | 8.246 | 0.006 | 11.016 | 0.003 | 14.74 | 0.004 | 90 | null | 96.84 | 0.04 | 90 | null | 1,329.4 | 1.1 | 295 | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | null | - C14 H14 N4 O2 - | - C14 H14 N4 O2 - | - C56 H56 N16 O8 - | 4 | 1 | OH1051 | Hirota, T.; Sasaki, K.; Yamamoto, H.; Mori, K.; Kashino, S. | Anomalous products formed from <i>N</i>-(5,6-dihydrobenzo[<i>h</i>]quinazolin-4-yl)amidines and hydroxylamine hydrochloride | Acta Crystallographica Section C | 1,994 | 50 | 5 | 807 | 810 | 10.1107/S0108270193010583 | 0.71073 | MoKα | null | 0.041 | null | null | 0.031 | null | null | null | null | 1.43 | 1.43 | null | null | null | has coordinates | Hirota, T.; Sasaki, K.; Yamamoto, H.; Mori, K.; Kashino, S.
Anomalous products formed from <i>N</i>-(5,6-dihydrobenzo[<i>h</i>]quinazolin-4-yl)amidines and hydroxylamine hydrochloride
Acta Crystallographica Section C
50(5)
(1994)
807-810 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,726 | 11.661 | 0.002 | 9.41 | 0.002 | 16.224 | 0.003 | 90 | null | 103.42 | 0.01 | 90 | null | 1,731.6 | 0.6 | 298 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C19 H15 Cl N4 O2 - | - C19 H15 Cl N4 O2 - | - C76 H60 Cl4 N16 O8 - | 4 | 1 | OH1051 | Hirota, T.; Sasaki, K.; Yamamoto, H.; Mori, K.; Kashino, S. | Anomalous products formed from <i>N</i>-(5,6-dihydrobenzo[<i>h</i>]quinazolin-4-yl)amidines and hydroxylamine hydrochloride | Acta Crystallographica Section C | 1,994 | 50 | 5 | 807 | 810 | 10.1107/S0108270193010583 | 0.71073 | MoKα | null | 0.057 | null | null | 0.037 | null | null | null | null | 1.5 | 1.5 | null | null | null | has coordinates | Hirota, T.; Sasaki, K.; Yamamoto, H.; Mori, K.; Kashino, S.
Anomalous products formed from <i>N</i>-(5,6-dihydrobenzo[<i>h</i>]quinazolin-4-yl)amidines and hydroxylamine hydrochloride
Acta Crystallographica Section C
50(5)
(1994)
807-810 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,787 | 9.638 | 0.005 | 9.715 | 0.005 | 7.237 | 0.004 | 90.96 | 0.01 | 105.72 | 0.01 | 119.74 | 0.01 | 557 | 0.5 | 298 | null | 298 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C12 H32 Al N5 O16 - | - C12 H31 Al N5 O16 - | - C12 H31 Al N5 O16 - | 1 | 0.5 | M. Matzapetakis; C. P. Raptopoulou; A. Terzis; A. Lakatos; T. Kiss; A. Salifoglou | Synthesis, Structural Characterization, and Solution Behavior of the First Mononuclear, Aqueous Aluminum Citrate Complex | Inorganic Chemistry | 1,999 | 38 | 618 | 619 | 10.1021/ic9806131 | 0.71073 | MoKα | 0.0706 | 0.0498 | null | 0.164 | 0.1477 | null | null | null | 1.068 | 1.12 | 1.12 | null | null | null | has coordinates | M. Matzapetakis; C. P. Raptopoulou; A. Terzis; A. Lakatos; T. Kiss; A. Salifoglou
Synthesis, Structural Characterization, and Solution Behavior of the First Mononuclear, Aqueous Aluminum Citrate Complex
Inorganic Chemistry
38
(1999)
618-619 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
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2,009,727 | 4.9635 | 0.0004 | 21.935 | 0.002 | 6.7924 | 0.0005 | 90 | null | 101.096 | 0.006 | 90 | null | 725.69 | 0.1 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | 3-β-D-Ribofuranosyl-6,7-dihydro-9H-thiazolo[3,2-a]purin-9-one | - C12 H16 N4 O6 S - | - C12 H16 N4 O6 S - | - C24 H32 N8 O12 S2 - | 2 | 1 | OH1058 | Liaw, Yen-Chywan; Wang, Andrew H.-J.; Lin, Guo-Sen; Chern, Ji-Wang | 3-β-<small>D</small>-Ribofuranosyl-6,7-dihydro-9<i>H</i>-thiazolo[3,2-<i>a</i>]purin-9-one hydrate | Acta Crystallographica Section C | 1,994 | 50 | 5 | 734 | 736 | 10.1107/S0108270193011850 | 1.54178 | CuKα | 0.0226 | 0.0222 | null | 0.06 | 0.0597 | null | null | null | 1.078 | 1.081 | 1.081 | null | null | null | has coordinates | Liaw, Yen-Chywan; Wang, Andrew H.-J.; Lin, Guo-Sen; Chern, Ji-Wang
3-β-<small>D</small>-Ribofuranosyl-6,7-dihydro-9<i>H</i>-thiazolo[3,2-<i>a</i>]purin-9-one hydrate
Acta Crystallographica Section C
50(5)
(1994)
734-736 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,728 | 11.947 | 0.002 | 11.333 | 0.002 | 21.114 | 0.006 | 109.38 | 0.02 | 94.85 | 0.02 | 90.33 | 0.01 | 2,685.4 | 1.1 | 295 | 1 | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C30 H25 N3 O4 S - | - C30 H25 N3 O4 S - | - C120 H100 N12 O16 S4 - | 4 | 2 | PA1044 | Theobald, F.; Rodier, N.; Aubry, C.; Ciamala, K.; Nguyen Dinh An | 2-Benzoyl-3-(4-methoxyphenyl)-4-methyl-1-phenyl-2,3-dihydro-1<i>H</i>-pyrazolo[4,3-<i>c</i>][1,2]benzothiazine 5,5-dioxide | Acta Crystallographica Section C | 1,994 | 50 | 5 | 791 | 794 | 10.1107/S0108270193010285 | 1.5418 | CuKα | null | 0.047 | null | null | 0.06 | null | null | null | null | 1.91 | 1.91 | null | null | null | has coordinates | Theobald, F.; Rodier, N.; Aubry, C.; Ciamala, K.; Nguyen Dinh An
2-Benzoyl-3-(4-methoxyphenyl)-4-methyl-1-phenyl-2,3-dihydro-1<i>H</i>-pyrazolo[4,3-<i>c</i>][1,2]benzothiazine 5,5-dioxide
Acta Crystallographica Section C
50(5)
(1994)
791-794 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,729 | 11.222 | 0.005 | 3.917 | 0.003 | 26.949 | 0.007 | 90 | null | 98.8 | 0.4 | 90 | null | 1,170.6 | 1.7 | 293 | 2 | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C13 H10 Cl N3 O - | - C13 H10 Cl N3 O - | - C52 H40 Cl4 N12 O4 - | 4 | 1 | PA1056 | Lewanowicz, A.; Baert, F. | 2-(2-Hydroxy-5-methylphenyl)-5-chlorobenzotriazole, C~13~H~10~ClN~3~O | Acta Crystallographica Section C | 1,994 | 50 | 5 | 801 | 803 | 10.1107/S0108270193010303 | 0.7107 | MoKα | null | 0.059 | null | null | 0.059 | null | null | null | null | 6.25 | 6.25 | null | null | null | has coordinates | Lewanowicz, A.; Baert, F.
2-(2-Hydroxy-5-methylphenyl)-5-chlorobenzotriazole, C~13~H~10~ClN~3~O
Acta Crystallographica Section C
50(5)
(1994)
801-803 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
#$Revision: 278324 $
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2,009,730 | 8.492 | 0.002 | 14.067 | 0.002 | 12.273 | 0.002 | 90 | null | 98.71 | 0.02 | 90 | null | 1,449.2 | 0.5 | 294 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C14 H13 N2 P S2 - | - C14 H13 N2 P S2 - | - C56 H52 N8 P4 S8 - | 4 | 1 | PA1065 | Rodier, N.; Cense, J.-M.; Robert, J.-M.; Robert-Piessard, S.; Courant, J.; Le Baut, G. | 3-Sulfure de 3-mercapto-5,7-diméthyl-2-phényl-3<i>H</i>-[1,4,2]diazaphospholo[1,5-<i>a</i>]pyridinium | Acta Crystallographica Section C | 1,994 | 50 | 5 | 810 | 813 | 10.1107/S0108270193010327 | 1.5418 | CuKα | null | 0.046 | null | null | 0.048 | null | null | null | null | 1.31 | 1.31 | null | null | null | has coordinates | Rodier, N.; Cense, J.-M.; Robert, J.-M.; Robert-Piessard, S.; Courant, J.; Le Baut, G.
3-Sulfure de 3-mercapto-5,7-diméthyl-2-phényl-3<i>H</i>-[1,4,2]diazaphospholo[1,5-<i>a</i>]pyridinium
Acta Crystallographica Section C
50(5)
(1994)
810-813 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,786 | 13.813 | 0.003 | 16.641 | 0.004 | 15.722 | 0.004 | 90 | null | 96.73 | 0.02 | 90 | null | 3,589 | 1.5 | 220 | 2 | 220 | 2 | null | null | null | null | see experimental | 7 | I 1 2/a 1 | -I 2ya | 15 | - C31 H35 F6 N4 O5 P Pt2 - | - C31 H35 F6 N4 O5 P Pt2 - | - C124 H140 F24 N16 O20 P4 Pt8 - | 4 | 0.5 | Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies | Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes | Inorganic Chemistry | 1,999 | 38 | 680 | 683 | 10.1021/ic9805170 | 0.71073 | MoKα | 0.048 | 0.0394 | null | 0.0984 | 0.0946 | null | null | null | 1.089 | 1.146 | 1.146 | null | null | null | has coordinates | Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies
Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes
Inorganic Chemistry
38
(1999)
680-683 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
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2,009,731 | 4.038 | 0.001 | 12.84 | 0.003 | 9.355 | 0.002 | 90 | null | 99.91 | 0.02 | 90 | null | 477.8 | 0.19 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/m 1 | -P 2yb | 11 | - C11 H8 N4 - | - C11 H8 N4 - | - C22 H16 N8 - | 2 | 0.5 | SE1017 | Tillmanns, E.; Schwabenländer, F.; Güssregen, S.; Hünig, S.; Metzenthin, T. | <i>N</i>,<i>N</i>'-Dicyano-4,7-indanquinone diimine | Acta Crystallographica Section C | 1,994 | 50 | 5 | 715 | 717 | 10.1107/S0108270193008066 | 0.7093 | Mo | null | 0.045 | null | null | 0.057 | null | null | null | null | 2.7 | 2.7 | null | null | null | has coordinates | Tillmanns, E.; Schwabenländer, F.; Güssregen, S.; Hünig, S.; Metzenthin, T.
<i>N</i>,<i>N</i>'-Dicyano-4,7-indanquinone diimine
Acta Crystallographica Section C
50(5)
(1994)
715-717 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,732 | 15.068 | 0.002 | 15.068 | 0.002 | 32.303 | 0.006 | 90 | null | 90 | null | 120 | null | 6,351.6 | 1.7 | 173 | null | null | null | null | null | null | null | 7 | R -3 :H | -R 3 | null | - C48 H114 Cl12 N4 Na2 O24 Ta6 - | - C48 H114 Cl12 N4 Na2 O24 Ta6 - | - C144 H342 Cl36 N12 Na6 O72 Ta18 - | 3 | 0.166667 | SH1052 | Beck, U.; Borrmann, H.; Simon, A. | (C~18~H~36~N~2~O~6~Na)~2~[Ta~6~Cl~12~(CH~3~O)~6~].6CH~3~OH with partial substitution of CH~3~O^{-^} by OH^{-^} | Acta Crystallographica Section C | 1,994 | 50 | 5 | 695 | 697 | 10.1107/S0108270193008546 | 0.71073 | MoKα | null | 0.0424 | null | null | 0.0427 | null | null | null | null | 1.2085 | 1.2085 | null | null | null | has coordinates | Beck, U.; Borrmann, H.; Simon, A.
(C~18~H~36~N~2~O~6~Na)~2~[Ta~6~Cl~12~(CH~3~O)~6~].6CH~3~OH with partial substitution of CH~3~O^{-^} by OH^{-^}
Acta Crystallographica Section C
50(5)
(1994)
695-697 | 283,803 | 2023-05-16 | 8:05:52 | #------------------------------------------------------------------------------
#$Date: 2023-05-16 11:05:35 +0300 (Tue, 16 May 2023) $
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2,009,733 | 8.31 | 0.002 | 16.473 | 0.007 | 10.32 | 0.005 | 90 | null | 113.6 | 0.03 | 90 | null | 1,294.6 | 0.9 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | null | - C11 H11 N O2 S3 - | - C11 H11 N O2 S3 - | - C44 H44 N4 O8 S12 - | 4 | 1 | SH1057 | Krüger, P.; Kustos, M.; Steudel, R. | Methyl 3-(1,3-benzothiazol-2-yldithio)propanoate, C~11~H~11~NO~2~S~3~ | Acta Crystallographica Section C | 1,994 | 50 | 5 | 767 | 769 | 10.1107/S0108270193008418 | 0.71069 | MoKα | null | 0.0422 | null | null | 0.0422 | null | null | null | null | 0.89 | 0.89 | null | null | null | has coordinates | Krüger, P.; Kustos, M.; Steudel, R.
Methyl 3-(1,3-benzothiazol-2-yldithio)propanoate, C~11~H~11~NO~2~S~3~
Acta Crystallographica Section C
50(5)
(1994)
767-769 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,734 | 21.647 | 0.005 | 11.738 | 0.002 | 11.415 | 0.003 | 90 | null | 90 | null | 90 | null | 2,900.5 | 1.1 | 293 | null | null | null | null | null | null | null | 6 | P n a 21 | P 2c -2n | null | - C22 H34 N8 O4 P2 S2 - | - C22 H34 N8 O4 P2 S2 - | - C88 H136 N32 O16 P8 S8 - | 4 | 1 | SH1063 | Engelhardt, U.; Rosefid, M. | Ein Zwölfring mit Phosphor(V), Kohlenstoff und Dimethylhydrazin als Ringbausteinen und grossen endocyclischen Torsionswinkeln um die N–N-Bindungen | Acta Crystallographica Section C | 1,994 | 50 | 5 | 775 | 777 | 10.1107/S0108270193008844 | 0.71069 | MoKα | null | 0.053 | null | null | 0.031 | null | null | null | null | 1.22 | 1.22 | null | null | null | has coordinates | Engelhardt, U.; Rosefid, M.
Ein Zwölfring mit Phosphor(V), Kohlenstoff und Dimethylhydrazin als Ringbausteinen und grossen endocyclischen Torsionswinkeln um die N–N-Bindungen
Acta Crystallographica Section C
50(5)
(1994)
775-777 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,735 | 8.011 | 0.006 | 12.205 | 0.01 | 22.336 | 0.013 | 90 | null | 90 | null | 90 | null | 2,184 | 3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | lithium bis[methyl α-L-rhamnopyranosid-(2,3)-ato(2-)]cuprate(II) tetrahydrate | - C14 H32 Cu Li2 O14 - | - C14 H32 Cu Li2 O14 - | - C56 H128 Cu4 Li8 O56 - | 4 | 1 | SH1071 | Klaassen, Markus; Klüfers, Peter | Polyol metal complexes. VI. Structure of lithium bis[methyl α-<small>L</small>-rhamnopyranosid(2,3)-ato(2‒)]cuprate(II) tetrahydrate | Acta Crystallographica Section C | 1,994 | 50 | 5 | 686 | 688 | 10.1107/S0108270193010522 | 0.71069 | MoKα | 0.0397 | 0.0288 | null | 0.0681 | 0.0643 | null | null | null | 1.031 | 1.054 | 1.054 | null | null | null | has coordinates | Klaassen, Markus; Klüfers, Peter
Polyol metal complexes. VI. Structure of lithium bis[methyl α-<small>L</small>-rhamnopyranosid(2,3)-ato(2‒)]cuprate(II) tetrahydrate
Acta Crystallographica Section C
50(5)
(1994)
686-688 | 199,607 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,785 | 21.147 | 0.006 | 14.3547 | 0.0015 | 23.036 | 0.004 | 90 | null | 116.78 | 0.02 | 90 | null | 6,243 | 2 | 220 | 2 | 220 | 2 | null | null | null | null | see experimental | 7 | P 1 21/a 1 | -P 2yab | 14 | - C28 H29 F6 N4 O4 P Pt2 - | - C28 H29 F6 N4 O4 P Pt2 - | - C224 H232 F48 N32 O32 P8 Pt16 - | 8 | 2 | Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies | Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes | Inorganic Chemistry | 1,999 | 38 | 680 | 683 | 10.1021/ic9805170 | 0.71073 | MoKα | 0.0574 | 0.0363 | null | 0.0845 | 0.0767 | null | null | null | 0.936 | 1.007 | 1.007 | null | null | null | has coordinates | Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies
Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes
Inorganic Chemistry
38
(1999)
680-683 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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#$Revision: 179320 $
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2,009,736 | 9.932 | 0.003 | 11.2 | 0.01 | 14.08 | 0.01 | 74.1 | 0.05 | 75.54 | 0.04 | 71.53 | 0.03 | 1,405.8 | 1.7 | 298 | null | 298 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | 1-tert-butyl-2,4,6-trimethyl-3,5-dinitrobenzene | - C13 H18 N2 O4 - | - C13 H18 N2 O4 - | - C52 H72 N8 O16 - | 4 | 2 | SH1072 | De Ridder, Dirk J.A.; Fraanje, Jan; Schenk, Henk | Crystal studies of musk compounds. VII. Molecular structures of 1-<i>tert</i>-butyl-2,4,6-trimethyl-3,5-dinitrobenzene, C~13~H~18~N~2~O~4~ (2), and 1-bromo-3,5-dimethyl-2,4,6-trinitrobenzene, C~8~H~6~BrN~3~O~6~ (4) | Acta Crystallographica Section C | 1,994 | 50 | 5 | 749 | 753 | 10.1107/S0108270193011242 | 1.5418 | CuKα | 0.061 | 0.061 | null | 0.089 | 0.089 | null | null | null | 0.281 | 0.281 | 0.281 | null | null | null | has coordinates | De Ridder, Dirk J.A.; Fraanje, Jan; Schenk, Henk
Crystal studies of musk compounds. VII. Molecular structures of 1-<i>tert</i>-butyl-2,4,6-trimethyl-3,5-dinitrobenzene, C~13~H~18~N~2~O~4~ (2), and 1-bromo-3,5-dimethyl-2,4,6-trinitrobenzene, C~8~H~6~BrN~3~O~6~ (4)
Acta Crystallographica Section C
50(5)
(1994)
749-753 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,737 | 5.4224 | 0.0009 | 8.975 | 0.001 | 12.094 | 0.002 | 77.82 | 0.009 | 84.19 | 0.02 | 76.46 | 0.01 | 558.5 | 0.15 | 298 | null | 298 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | 1-Bromo-3,5-dimethyl-2,4,6-trinitrobenzene | - C8 H6 Br N3 O6 - | - C8 H6 Br N3 O6 - | - C16 H12 Br2 N6 O12 - | 2 | 1 | SH1072 | De Ridder, Dirk J.A.; Fraanje, Jan; Schenk, Henk | Crystal studies of musk compounds. VII. Molecular structures of 1-<i>tert</i>-butyl-2,4,6-trimethyl-3,5-dinitrobenzene, C~13~H~18~N~2~O~4~ (2), and 1-bromo-3,5-dimethyl-2,4,6-trinitrobenzene, C~8~H~6~BrN~3~O~6~ (4) | Acta Crystallographica Section C | 1,994 | 50 | 5 | 749 | 753 | 10.1107/S0108270193011242 | 1.5418 | CuKα | 0.073 | 0.073 | null | 0.095 | 0.095 | null | null | null | 0.286 | 0.286 | 0.286 | null | null | null | has coordinates | De Ridder, Dirk J.A.; Fraanje, Jan; Schenk, Henk
Crystal studies of musk compounds. VII. Molecular structures of 1-<i>tert</i>-butyl-2,4,6-trimethyl-3,5-dinitrobenzene, C~13~H~18~N~2~O~4~ (2), and 1-bromo-3,5-dimethyl-2,4,6-trinitrobenzene, C~8~H~6~BrN~3~O~6~ (4)
Acta Crystallographica Section C
50(5)
(1994)
749-753 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,738 | 10.22 | 0.02 | 10.22 | 0.02 | 10.22 | 0.02 | 90 | null | 90 | null | 90 | null | 1,067 | 4 | 293 | null | null | null | null | null | null | null | 3 | I 2 3 | I 2 2 3 | null | - Bi12.5 O19.5 Tl0.5 - | - Bi12.5 O19.52 Tl0.5 - | - Bi25 O39.04 Tl - | 2 | 0.083333 | SH1073 | Radaev, S. F.; Trömel, M.; Kargin, Y. F.; Marin, A. A.; Rider, E. E.; Sarin, V. A. | Bi~12~(Bi~0.5~^III^Tl~0.5~^III^)O~19.50~ | Acta Crystallographica Section C | 1,994 | 50 | 5 | 656 | 659 | 10.1107/S0108270193011205 | neutron | 1.167 | neutron | null | 0.0172 | null | null | 0.0145 | null | null | null | null | 1.47 | 1.47 | null | null | null | has coordinates | Radaev, S. F.; Trömel, M.; Kargin, Y. F.; Marin, A. A.; Rider, E. E.; Sarin, V. A.
Bi~12~(Bi~0.5~^III^Tl~0.5~^III^)O~19.50~
Acta Crystallographica Section C
50(5)
(1994)
656-659 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,784 | 8.119 | 0.002 | 9.243 | 0.003 | 12.822 | 0.004 | 76.15 | 0.03 | 89.39 | 0.03 | 69.63 | 0.03 | 873 | 0.5 | 220 | 2 | 220 | 2 | null | null | null | null | see experimental | 7 | P -1 | -P 1 | 2 | - C14 H15 F6 N2 O2 P Pt - | - C14 H15 F6 N2 O2 P Pt - | - C28 H30 F12 N4 O4 P2 Pt2 - | 2 | 1 | Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies | Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes | Inorganic Chemistry | 1,999 | 38 | 680 | 683 | 10.1021/ic9805170 | 0.71073 | MoKα | 0.0351 | 0.0339 | null | 0.0829 | 0.0822 | null | null | null | 1.099 | 1.122 | 1.122 | null | null | null | has coordinates | Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies
Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes
Inorganic Chemistry
38
(1999)
680-683 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,739 | 6.944 | 0.001 | 20.42 | 0.002 | 5.836 | 0.001 | 90 | null | 114.15 | 0.01 | 90 | null | 755.1 | 0.19 | 295 | null | null | null | null | null | null | null | 2 | P 1 21/c 1 | -P 2ybc | null | - P2 Se5 - | - P2 Se5 - | - P8 Se20 - | 4 | 1 | SH1075 | Blachnik, R.; Lönnecke, P. | P~2~Se~5~ | Acta Crystallographica Section C | 1,994 | 50 | 5 | 659 | 661 | 10.1107/S0108270193010534 | 0.7093 | MoKα | null | 0.035 | null | null | 0.034 | null | null | null | null | 2.42 | 2.42 | null | null | null | has coordinates | Blachnik, R.; Lönnecke, P.
P~2~Se~5~
Acta Crystallographica Section C
50(5)
(1994)
659-661 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,740 | 20.845 | 0.004 | 7.927 | 0.001 | 17.08 | 0.003 | 90 | null | 91.61 | 0.01 | 90 | null | 2,821.2 | 0.8 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C15 H14 Br N O2 - | - C15 H14 Br N O2 - | - C120 H112 Br8 N8 O16 - | 8 | 2 | SH1077 | Berger, B.; Bolte, M. | 3-Bromo-6-methylamino-2'-methoxybenzophenone | Acta Crystallographica Section C | 1,994 | 50 | 5 | 773 | 775 | 10.1107/S0108270193011217 | 1.5418 | CuKα | null | null | null | null | null | null | null | null | null | 5.1 | 5.1 | null | null | null | has coordinates | Berger, B.; Bolte, M.
3-Bromo-6-methylamino-2'-methoxybenzophenone
Acta Crystallographica Section C
50(5)
(1994)
773-775 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,741 | 10.213 | 0.002 | 8.151 | 0.001 | 17.671 | 0.003 | 90 | null | 94.83 | 0.02 | 90 | null | 1,465.8 | 0.4 | 196 | null | 196 | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 4-acetyl-1,1,3,3,5,6-hexamethylindan | - C17 H24 O - | - C17 H24 O - | - C68 H96 O4 - | 4 | 1 | SH1084 | De Ridder, Dirk J.A.; Fraanje, Jan; Schenk, Henk | Crystal studies of musk compounds. IX. 4-Acetyl-1,1,3,3,5,6-hexamethylindan | Acta Crystallographica Section C | 1,994 | 50 | 5 | 753 | 755 | 10.1107/S0108270193012399 | 1.5418 | CuKα | 0.05 | 0.05 | null | 0.064 | 0.064 | null | null | null | 0.159 | 0.159 | 0.159 | null | null | null | has coordinates | De Ridder, Dirk J.A.; Fraanje, Jan; Schenk, Henk
Crystal studies of musk compounds. IX. 4-Acetyl-1,1,3,3,5,6-hexamethylindan
Acta Crystallographica Section C
50(5)
(1994)
753-755 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,742 | 13.327 | 0.001 | 7.0693 | 0.0009 | 14.115 | 0.001 | 90 | null | 104.588 | 0.009 | 90 | null | 1,286.9 | 0.2 | 231 | null | 231 | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 1,1,2,3,3-pentamethyl-2,3,4,5,6,7-hexahydroinden-4-one | - C14 H22 O - | - C14 H22 O - | - C56 H88 O4 - | 4 | 1 | SH1085 | De Ridder, Dirk J. A.; Fraanje, Jan; Schenk, Henk; 1,1,2,3,3-pentamethyl-2,3,4,5,6,7-hexahydroinden-4-one | Crystal studies of musk compounds. X. 1,1,2,3,3-Pentamethyl-2,3,4,5,6,7-hexahydroinden-4-one | Acta Crystallographica Section C | 1,994 | 50 | 5 | 755 | 757 | 10.1107/S0108270193012405 | 1.5418 | CuKα | 0.084 | 0.084 | null | 0.11 | 0.11 | null | null | null | 0.268 | 0.268 | 0.268 | null | null | null | has coordinates | De Ridder, Dirk J. A.; Fraanje, Jan; Schenk, Henk; 1,1,2,3,3-pentamethyl-2,3,4,5,6,7-hexahydroinden-4-one
Crystal studies of musk compounds. X. 1,1,2,3,3-Pentamethyl-2,3,4,5,6,7-hexahydroinden-4-one
Acta Crystallographica Section C
50(5)
(1994)
755-757 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,743 | 6.648 | 0.003 | 20.473 | 0.005 | 6.4 | 0.003 | 90 | null | 90 | null | 90 | null | 871.1 | 0.6 | 173 | 1 | 173 | 1 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | 1-deoxynojirimycin hydrochloride | 1,5-Dideoxy-1,5-iminium-glucitol chloride | - C6 H14 Cl N O4 - | - C6 H14 Cl N O4 - | - C24 H56 Cl4 N4 O16 - | 4 | 1 | SH1087 | Linden, Anthony; Hoos, Roland; Vasella, Andrea | 1-Deoxynojirimycin hydrochloride | Acta Crystallographica Section C | 1,994 | 50 | 5 | 746 | 749 | 10.1107/S0108270193012417 | 0.71069 | MoKα | 0.0285 | 0.0233 | null | 0.0256 | 0.025 | null | null | null | null | 1.583 | 1.583 | null | null | null | has coordinates | Linden, Anthony; Hoos, Roland; Vasella, Andrea
1-Deoxynojirimycin hydrochloride
Acta Crystallographica Section C
50(5)
(1994)
746-749 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,783 | 60.2 | 0.006 | 14.977 | 0.002 | 19.066 | 0.003 | 90 | null | 98.367 | 0.014 | 90 | null | 17,007 | 4 | 173 | 2 | 173 | 2 | null | null | null | null | 10 | C 1 2/c 1 | -C 2yc | 15 | - C74 H69 Au3 Cl10 F6 Fe N O6 P3 S3 - | - C74 H65 Au3 Cl10 F6 Fe N O6 P3 S3 - | - C592 H520 Au24 Cl80 F48 Fe8 N8 O48 P24 S24 - | 8 | 1 | Eva M. Barranco; M. Concepción Gimeno; Peter G. Jones; Antonio Laguna; M. Dolores Villacampa | Synthesis of the Ferrocene Derivative FcCHN(CH~2~)~2~SH [Fc = (η5-C~5~H~5~)Fe(η5-C~5~H~4~)]: Reactivity toward (Phosphine)gold(I) Cations | Inorganic Chemistry | 1,999 | 38 | 702 | 706 | 10.1021/ic980379e | 0.71073 | MoKα | 0.1192 | 0.052 | null | 0.105 | 0.0918 | null | null | null | 0.776 | 0.977 | 0.977 | null | null | null | has coordinates | Eva M. Barranco; M. Concepción Gimeno; Peter G. Jones; Antonio Laguna; M. Dolores Villacampa
Synthesis of the Ferrocene Derivative FcCHN(CH~2~)~2~SH [Fc = (η5-C~5~H~5~)Fe(η5-C~5~H~4~)]: Reactivity toward (Phosphine)gold(I) Cations
Inorganic Chemistry
38
(1999)
702-706 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
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2,009,744 | 10.805 | 0.001 | 10.114 | 0.001 | 13.11 | 0.001 | 90 | null | 90 | null | 90 | null | 1,432.7 | 0.2 | 296 | null | null | null | null | null | null | null | 5 | P b c n | -P 2n 2ab | null | - C8 H16 Cl3 In O2 - | - C8 H16 Cl3 In O2 - | - C32 H64 Cl12 In4 O8 - | 4 | 0.5 | ST1063 | Whittlesey, B. R.; Ittycheriah, I. P. | Trichlorobis(tetrahydrofuran)indium(III) | Acta Crystallographica Section C | 1,994 | 50 | 5 | 693 | 695 | 10.1107/S0108270193010613 | 0.71073 | MoKα | null | 0.0347 | null | null | 0.033 | null | null | null | null | 1.52 | 1.52 | null | null | null | has coordinates | Whittlesey, B. R.; Ittycheriah, I. P.
Trichlorobis(tetrahydrofuran)indium(III)
Acta Crystallographica Section C
50(5)
(1994)
693-695 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,745 | 12.628 | 0.002 | 14.679 | 0.004 | 13.644 | 0.003 | 90 | null | 102.25 | 0.02 | 90 | null | 2,471.6 | 1 | 183 | null | null | null | null | null | null | null | 6 | P 1 21/a 1 | -P 2yab | 14 | - C13 H37 Li O2 Se Si4 - | - C13 H37 Li O2 Se Si4 - | - C52 H148 Li4 O8 Se4 Si16 - | 4 | 1 | ST1075 | Flick, Karen E.; Bonasia, Philip J.; Gindelberger, David E.; Katari, Janet E. B.; Schwartz, David | Lithium tris(trimethylsilyl)silylselenolate mono(1,2-dimethoxyethane) | Acta Crystallographica Section C | 1,994 | 50 | 5 | 674 | 675 | 10.1107/S0108270193007206 | 0.71073 | MoKα | null | 0.028 | null | null | 0.03 | null | null | null | null | 1.129 | 1.129 | null | null | null | has coordinates | Flick, Karen E.; Bonasia, Philip J.; Gindelberger, David E.; Katari, Janet E. B.; Schwartz, David
Lithium tris(trimethylsilyl)silylselenolate mono(1,2-dimethoxyethane)
Acta Crystallographica Section C
50(5)
(1994)
674-675 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,746 | 9.384 | 0.002 | 12.059 | 0.003 | 4.595 | 0.002 | 95.32 | 0.03 | 95.97 | 0.03 | 110.13 | 0.02 | 480.9 | 0.3 | null | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C9 H5 Cl N2 O S - | - C9 H5 Cl N2 O S - | - C18 H10 Cl2 N4 O2 S2 - | 2 | 1 | AB1087 | Ergi̇n, O.; Sillanpää, R.; Safak, C.; Calis, İ. | (5-Chloro-1,3-benzoxazol-2-ylthio)acetonitrile | Acta Crystallographica Section C | 1,994 | 50 | 6 | 933 | 935 | 10.1107/S0108270193011928 | 0.71069 | MoKα | null | 0.066 | null | null | 0.079 | null | null | null | null | 2.38 | 2.38 | null | null | null | has coordinates | Ergi̇n, O.; Sillanpää, R.; Safak, C.; Calis, İ.
(5-Chloro-1,3-benzoxazol-2-ylthio)acetonitrile
Acta Crystallographica Section C
50(6)
(1994)
933-935 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,747 | 6.612 | 0.001 | 7.685 | 0.001 | 17.191 | 0.002 | 90 | null | 90 | null | 90 | null | 873.5 | 0.2 | 296 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | - C7 H12 O7 - | - C7 H12 O7 - | - C28 H48 O28 - | 4 | 1 | AB1093 | Søtofte, I. | <small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-Heptono- (I) and 2,7-ditosyl-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-heptono-1,4-lactone (II) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 938 | 941 | 10.1107/S0108270193010212 | 0.71073 | MoKα | null | 0.039 | null | null | 0.04 | null | null | null | null | 1.27 | 1.27 | null | null | null | has coordinates | Søtofte, I.
<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-Heptono- (I) and 2,7-ditosyl-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-heptono-1,4-lactone (II)
Acta Crystallographica Section C
50(6)
(1994)
938-941 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,748 | 5.781 | 0.002 | 19.526 | 0.003 | 20.538 | 0.004 | 90 | null | 90 | null | 90 | null | 2,318.3 | 1 | 296 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C21 H24 O11 S2 - | - C21 H24 O11 S2 - | - C84 H96 O44 S8 - | 4 | 1 | AB1093 | Søtofte, I. | <small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-Heptono- (I) and 2,7-ditosyl-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-heptono-1,4-lactone (II) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 938 | 941 | 10.1107/S0108270193010212 | 0.71073 | MoKα | null | 0.071 | null | null | 0.046 | null | null | null | null | 1.37 | 1.37 | null | null | null | has coordinates | Søtofte, I.
<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-Heptono- (I) and 2,7-ditosyl-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-heptono-1,4-lactone (II)
Acta Crystallographica Section C
50(6)
(1994)
938-941 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,749 | 16.548 | 0.007 | 14.854 | 0.008 | 5.377 | 0.009 | 90 | null | 90 | null | 90 | null | 1,322 | 2 | 120 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C8 H14 O10 S2 - | - C8 H14 O10 S2 - | - C32 H56 O40 S8 - | 4 | 1 | AB1094 | Søtofte, I. | 2,6-Dimesyl-<small>D</small>-<i>manno</i>-hexono- (III), 2,6-dimesyl-<small>D</small>-<i>allo</i>-hexono- (IV) and 2,6-dimesyl-<small>D</small>-<i>gulo</i>-hexono-1,4-lactone (V) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 941 | 945 | 10.1107/S0108270193010224 | 1.5418 | CuKα | null | 0.081 | null | null | 0.106 | null | null | null | null | 1.23 | 1.23 | null | null | null | has coordinates | Søtofte, I.
2,6-Dimesyl-<small>D</small>-<i>manno</i>-hexono- (III), 2,6-dimesyl-<small>D</small>-<i>allo</i>-hexono- (IV) and 2,6-dimesyl-<small>D</small>-<i>gulo</i>-hexono-1,4-lactone (V)
Acta Crystallographica Section C
50(6)
(1994)
941-945 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,782 | 8.875 | 0.002 | 18.629 | 0.002 | 15.399 | 0.002 | 90 | null | 91.37 | 0.02 | 90 | null | 2,545.2 | 0.7 | 294.2 | null | 294.2 | null | null | null | null | null | 7 | P 1 21/n 1 | -P 2yn | 14 | - C20 H33 Cl N4 Ni O5 S2 - | - C20 H33 Cl N4 Ni O5 S2 - | - C80 H132 Cl4 N16 Ni4 O20 S8 - | 4 | 1 | Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury | Nickel(II) in an N4S Donor Environment: An Unprecedented Alcoholysis Reaction through the Activation of a Carbon-Nitrogen Single Bond | Inorganic Chemistry | 1,999 | 38 | 633 | 638 | 10.1021/ic9703888 | 0.7107 | MoKalpha | null | 0.0486 | null | null | 0.0529 | null | null | null | null | 2.663 | 2.663 | null | null | null | has coordinates | Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury
Nickel(II) in an N4S Donor Environment: An Unprecedented Alcoholysis Reaction through the Activation of a Carbon-Nitrogen Single Bond
Inorganic Chemistry
38
(1999)
633-638 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
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2,009,750 | 10.277 | 0.002 | 5.26 | 0.002 | 12.07 | 0.003 | 90 | null | 93.36 | 0.02 | 90 | null | 651.3 | 0.3 | 120 | null | null | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C8 H14 O10 S2 - | - C8 H14 O10 S2 - | - C16 H28 O20 S4 - | 2 | 1 | AB1094 | Søtofte, I. | 2,6-Dimesyl-<small>D</small>-<i>manno</i>-hexono- (III), 2,6-dimesyl-<small>D</small>-<i>allo</i>-hexono- (IV) and 2,6-dimesyl-<small>D</small>-<i>gulo</i>-hexono-1,4-lactone (V) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 941 | 945 | 10.1107/S0108270193010224 | 0.71073 | MoKα | null | 0.04 | null | null | 0.041 | null | null | null | null | 1.21 | 1.21 | null | null | null | has coordinates | Søtofte, I.
2,6-Dimesyl-<small>D</small>-<i>manno</i>-hexono- (III), 2,6-dimesyl-<small>D</small>-<i>allo</i>-hexono- (IV) and 2,6-dimesyl-<small>D</small>-<i>gulo</i>-hexono-1,4-lactone (V)
Acta Crystallographica Section C
50(6)
(1994)
941-945 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,751 | 5.711 | 0.003 | 8.941 | 0.003 | 12.99 | 0.005 | 90 | null | 101.71 | 0.03 | 90 | null | 649.5 | 0.5 | 120 | null | null | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C8 H14 O10 S2 - | - C8 H14 O10 S2 - | - C16 H28 O20 S4 - | 2 | 1 | AB1094 | Søtofte, I. | 2,6-Dimesyl-<small>D</small>-<i>manno</i>-hexono- (III), 2,6-dimesyl-<small>D</small>-<i>allo</i>-hexono- (IV) and 2,6-dimesyl-<small>D</small>-<i>gulo</i>-hexono-1,4-lactone (V) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 941 | 945 | 10.1107/S0108270193010224 | 0.71073 | MoKα | null | 0.043 | null | null | 0.043 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Søtofte, I.
2,6-Dimesyl-<small>D</small>-<i>manno</i>-hexono- (III), 2,6-dimesyl-<small>D</small>-<i>allo</i>-hexono- (IV) and 2,6-dimesyl-<small>D</small>-<i>gulo</i>-hexono-1,4-lactone (V)
Acta Crystallographica Section C
50(6)
(1994)
941-945 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,752 | 9.2287 | 0.0009 | 14.191 | 0.0012 | 23.2013 | 0.0015 | 90 | null | 95.835 | 0.006 | 90 | null | 3,022.8 | 0.4 | 293 | null | 293 | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 2,2,2-Triphenylethanol | 2,2,2-Triphenylethanol | - C20 H18 O - | - C20 H18 O - | - C160 H144 O8 - | 8 | 2 | AB1164 | Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M. | 2,2,2-Triphenylethanol: a hydrogen-bonded tetramer based upon a centrosymmetric <i>R</i>~4~^4^(8) motif | Acta Crystallographica Section C | 1,994 | 50 | 6 | 928 | 931 | 10.1107/S0108270194002179 | 0.71067 | MoKα | 0.041 | 0.041 | null | 0.061 | 0.061 | null | null | null | null | 1.51 | 1.51 | null | null | null | has coordinates | Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M.
2,2,2-Triphenylethanol: a hydrogen-bonded tetramer based upon a centrosymmetric <i>R</i>~4~^4^(8) motif
Acta Crystallographica Section C
50(6)
(1994)
928-931 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,753 | 13.5889 | 0.0017 | 13.752 | 0.003 | 9.7843 | 0.001 | 90 | null | 101.785 | 0.01 | 90 | null | 1,789.9 | 0.5 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | 14 | Tetracarbonyl[1-phenyl-N-(2-pyridylmethylidene)ethylamine-N,N']molybdenum(0) | - C18 H14 Mo N2 O4 - | - C18 H14 Mo N2 O4 - | - C72 H56 Mo4 N8 O16 - | 4 | 1 | AB1177 | Alyea, Elmer C.; Ferguson, George; Jain, Vimal K. | Tetracarbonyl[1-phenyl-<i>N</i>-(2-pyridylmethylidene)ethylamine-<i>N</i>,<i>N</i>']molybdenum(0) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 854 | 857 | 10.1107/S0108270194003197 | 0.71069 | MoKα | 0.025 | 0.025 | null | 0.031 | 0.031 | null | null | null | null | 1 | 1 | null | null | null | has coordinates | Alyea, Elmer C.; Ferguson, George; Jain, Vimal K.
Tetracarbonyl[1-phenyl-<i>N</i>-(2-pyridylmethylidene)ethylamine-<i>N</i>,<i>N</i>']molybdenum(0)
Acta Crystallographica Section C
50(6)
(1994)
854-857 | 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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4,321,781 | 10.4886 | 0.0005 | 10.706 | 0.001 | 11.487 | 0.001 | 108.784 | 0.008 | 108.887 | 0.006 | 95.139 | 0.006 | 1,128.07 | 0.18 | 293.2 | null | 293.2 | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C17 H27 Cl N4 Ni O5 S2 - | - C17 H27 Cl N4 Ni O5 S2 - | - C34 H54 Cl2 N8 Ni2 O10 S4 - | 2 | 1 | Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury | Nickel(II) in an N4S Donor Environment: An Unprecedented Alcoholysis Reaction through the Activation of a Carbon-Nitrogen Single Bond | Inorganic Chemistry | 1,999 | 38 | 633 | 638 | 10.1021/ic9703888 | 0.7107 | MoKalpha | null | 0.0418 | null | null | 0.0541 | null | null | null | null | 2.688 | 2.688 | null | null | null | has coordinates | Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury
Nickel(II) in an N4S Donor Environment: An Unprecedented Alcoholysis Reaction through the Activation of a Carbon-Nitrogen Single Bond
Inorganic Chemistry
38
(1999)
633-638 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
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2,009,754 | 7.22 | 0.002 | 9.528 | 0.002 | 32.344 | 0.007 | 90 | null | 90 | null | 90 | null | 2,225 | 0.9 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C25 H31 N O5 - | - C25 H31 N O5 - | - C100 H124 N4 O20 - | 4 | 1 | AL1065 | Woudenberg, R. H.; Koningsveld, H. V.; Maat, L. | Structure of a Diels–Alder adduct at a 5,7-disubstituted thebaine derivative | Acta Crystallographica Section C | 1,994 | 50 | 6 | 913 | 915 | 10.1107/S0108270193010777 | 0.71073 | MoKα | null | 5.6 | null | null | 5.3 | null | null | null | null | 3.6 | 3.6 | null | null | null | has coordinates | Woudenberg, R. H.; Koningsveld, H. V.; Maat, L.
Structure of a Diels–Alder adduct at a 5,7-disubstituted thebaine derivative
Acta Crystallographica Section C
50(6)
(1994)
913-915 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,755 | 10.165 | 0.002 | 10.191 | 0.002 | 11.004 | 0.002 | 66.77 | 0.01 | 70.41 | 0.01 | 87.56 | 0.01 | 981.6 | 0.3 | 293 | null | 293 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | Di-chloro-4,7-diphenyl-1,10-phenantroline copper (II). | - C24 H16 Cl2 Cu N2 - | - C24 H16 Cl2 Cu N2 - | - C48 H32 Cl4 Cu2 N4 - | 2 | 1 | AS1079 | Atria, A.M.; Baggio, R.F.; Garland, M.T.; Spodine, E. | Di-μ-chlorobis[chloro(4,7-diphenyl-1,10-phenanthroline)copper(II)] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 864 | 866 | 10.1107/S010827019301217X | 0.71073 | MoKα | 6.25 | 0.036 | null | 6.25 | 0.036 | null | null | null | null | 1.35 | 1.35 | null | null | null | has coordinates | Atria, A.M.; Baggio, R.F.; Garland, M.T.; Spodine, E.
Di-μ-chlorobis[chloro(4,7-diphenyl-1,10-phenanthroline)copper(II)]
Acta Crystallographica Section C
50(6)
(1994)
864-866 | 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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2,009,756 | 7.71 | 0.001 | 8.132 | 0.001 | 11.024 | 0.002 | 90 | null | 108.16 | 0.01 | 90 | null | 656.75 | 0.17 | 291 | 1 | 291 | 1 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 3-selenocyanatopyridine | - C6 H4 N2 Se - | - C6 H4 N2 Se - | - C24 H16 N8 Se4 - | 4 | 1 | AS1090 | Dunne, S. J.; Summers, L. A.; von Nagy-Felsobuki, E. I.; Mackay, M. F. | 3-Selenocyanatopyridine | Acta Crystallographica Section C | 1,994 | 50 | 6 | 971 | 974 | 10.1107/S0108270193013927 | 1.5418 | CuKα | null | 0.038 | null | null | 0.058 | null | null | null | null | 2.82 | 2.82 | null | null | null | has coordinates | Dunne, S. J.; Summers, L. A.; von Nagy-Felsobuki, E. I.; Mackay, M. F.
3-Selenocyanatopyridine
Acta Crystallographica Section C
50(6)
(1994)
971-974 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,757 | 11.14 | 0.01 | 27.092 | 0.003 | 7.179 | 0.004 | 90 | null | 90 | null | 90 | null | 2,167 | 2 | 293 | null | 295 | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | - C9 H10 Hg O2 S - | - C9 H10 Hg O S2 - | - C72 H80 Hg8 O8 S16 - | 8 | 1 | AS1099 | Tiekink, Edward R.T. | (<i>O</i>-Ethyl dithiocarbonato-κ<i>S</i>)phenylmercury, [Hg(C~3~H~5~OS~2~)(C~6~H~5~)] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 861 | 862 | 10.1107/S0108270194000259 | 0.71073 | MoKα | 0.215 | 0.043 | null | 0.178 | 0.047 | null | null | null | 4.81 | 1.86 | 1.86 | null | null | null | has coordinates | Tiekink, Edward R.T.
(<i>O</i>-Ethyl dithiocarbonato-κ<i>S</i>)phenylmercury, [Hg(C~3~H~5~OS~2~)(C~6~H~5~)]
Acta Crystallographica Section C
50(6)
(1994)
861-862 | 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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2,009,758 | 16.786 | 0.001 | 15.099 | 0.001 | 13.291 | 0.002 | 90 | null | 90 | null | 90 | null | 3,368.6 | 0.6 | 294 | null | 294 | null | null | null | null | null | 3 | P b c a | -P 2ac 2ab | 61 | 2-Propyl 12-carboxy-9,10-dihydro-9,10- ethenoanthracene-11-carboxylate | - C21 H18 O4 - | - C21 H18 O4 - | - C168 H144 O32 - | 8 | 1 | BK1006 | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James | Isopropyl hydrogen 9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate | Acta Crystallographica Section C | 1,994 | 50 | 6 | 922 | 924 | 10.1107/S0108270193014003 | 1.5418 | CopperKα | 0.122 | 0.055 | null | 0.081 | 0.077 | null | null | null | null | 2.05 | 2.05 | null | null | null | has coordinates | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James
Isopropyl hydrogen 9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate
Acta Crystallographica Section C
50(6)
(1994)
922-924 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,759 | 14.402 | 0.002 | 27.795 | 0.004 | 4.152 | 0.001 | 90 | null | 90 | null | 90 | null | 1,662.1 | 0.5 | 295 | 2 | 295 | 2 | null | null | null | null | 4 | F d d 2 | F 2 -2d | 43 | - C4 H6 N8 O4 - | - C4 H6 N8 O4 - | - C32 H48 N64 O32 - | 8 | 0.5 | BK1017 | Flippen-Anderson, Judith L.; Kony, Michael; Dagley, Ian J. | A high-density thermally stable explosive: octahydro-2,5-bis(nitroimino)imidazo[4,5-<i>d</i>]imidazole | Acta Crystallographica Section C | 1,994 | 50 | 6 | 974 | 976 | 10.1107/S010827019400048X | 1.54178 | CuKα | 0.0471 | 0.0455 | null | 0.1279 | 0.1238 | null | null | null | 1.147 | 1.143 | 1.143 | null | null | null | has coordinates | Flippen-Anderson, Judith L.; Kony, Michael; Dagley, Ian J.
A high-density thermally stable explosive: octahydro-2,5-bis(nitroimino)imidazo[4,5-<i>d</i>]imidazole
Acta Crystallographica Section C
50(6)
(1994)
974-976 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,760 | 10.075 | 0.002 | 10.17 | 0.003 | 15.015 | 0.004 | 71.27 | 0.03 | 74.01 | 0.02 | 64.28 | 0.02 | 1,295.8 | 0.6 | 295 | null | null | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C27 H26 Cl2 N2 O2 P Re - | - C27 H26 Cl2 N2 O2 P Re - | - C54 H52 Cl4 N4 O4 P2 Re2 - | 2 | 1 | BR1050 | Lebuis, A. -M.; Beauchamp, A. L. | (<i>OC</i>-6-14)-(7-Azaindole)dichloro(ethoxo)oxo(triphenylphosphine)rhenium(V) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 882 | 884 | 10.1107/S0108270193011734 | 0.7093 | MoKα | null | 0.038 | null | null | 0.039 | null | null | null | null | 1.3 | 1.3 | null | null | null | has coordinates | Lebuis, A. -M.; Beauchamp, A. L.
(<i>OC</i>-6-14)-(7-Azaindole)dichloro(ethoxo)oxo(triphenylphosphine)rhenium(V)
Acta Crystallographica Section C
50(6)
(1994)
882-884 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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4,321,780 | 9.763 | 0.003 | 10.255 | 0.004 | 11.607 | 0.006 | 114.01 | 0.04 | 95.03 | 0.03 | 95.23 | 0.03 | 1,047.1 | 0.8 | 200 | 2 | 200 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C36 H52 Fe2 N4 O4 S6 - | - C36 H52 Fe2 N4 O4 S6 - | - C36 H52 Fe2 N4 O4 S6 - | 1 | 0.5 | Dieter Sellmann; Jürgen Utz; Frank W. Heinemann | Transition-Metal Complexes with Sulfur Ligands. 132.1 Electron-Rich Fe and Ru Complexes with [MN~2~S~3~] Cores Containing the New Pentadentate Ligand 'N~2~H~2~S~3~'^2-^ (= 2,2'-Bis(2-mercaptophenylamino)diethyl Sulfide(2-)) | Inorganic Chemistry | 1,999 | 38 | 459 | 466 | 10.1021/ic980383q | 0.71073 | MoKα | 0.0435 | 0.036 | null | 0.1052 | 0.1026 | null | null | null | 1.081 | 1.183 | 1.183 | null | null | null | has coordinates | Dieter Sellmann; Jürgen Utz; Frank W. Heinemann
Transition-Metal Complexes with Sulfur Ligands. 132.1 Electron-Rich Fe and Ru Complexes with [MN~2~S~3~] Cores Containing the New Pentadentate Ligand 'N~2~H~2~S~3~'^2-^ (= 2,2'-Bis(2-mercaptophenylamino)diethyl Sulfide(2-))
Inorganic Chemistry
38
(1999)
459-466 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
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2,009,761 | 10.613 | 0.001 | 13.313 | 0.003 | 15.272 | 0.003 | 92.96 | 0.02 | 94.73 | 0.01 | 92.75 | 0.02 | 2,144.6 | 0.7 | 293 | null | null | null | null | null | null | null | 8 | P -1 | -P 1 | 2 | - C42 H35 Cl3 F6 N P3 Pt S - | - C42 H30 Cl3 F6 N P3 Pt S - | - C84 H60 Cl6 F12 N2 P6 Pt2 S2 - | 2 | 1 | BR1051 | Wang, S.; Staples, R.J.; Fackler, J.P. | (Pyridine-2-thiolato-<i>N</i>,<i>S</i>)bis(triphenylphosphine)platinum(II) hexafluorophosphate chloroform solvate | Acta Crystallographica Section C | 1,994 | 50 | 6 | 889 | 891 | 10.1107/S0108270193011813 | 0.71073 | Mo | null | 0.0399 | null | null | 0.0521 | null | null | null | null | 1.241 | 1.241 | null | null | null | has coordinates | Wang, S.; Staples, R.J.; Fackler, J.P.
(Pyridine-2-thiolato-<i>N</i>,<i>S</i>)bis(triphenylphosphine)platinum(II) hexafluorophosphate chloroform solvate
Acta Crystallographica Section C
50(6)
(1994)
889-891 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,762 | 7.904 | 0.002 | 9.46 | 0.002 | 10.261 | 0.002 | 101.2 | 0.2 | 92.74 | 0.02 | 110.22 | 0.02 | 700.7 | 0.7 | 295 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C10 H18 Br10 Cu4 N4 O2 - | - C10 H18 Br10 Cu4 N4 O2 - | - C10 H18 Br10 Cu4 N4 O2 - | 1 | 0.5 | CD1014 | Place, H.; Willett, R. | Bis(4-aminopyridinium) hexabromodicuprate(II) diaquatetrabromodicopper(II) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 862 | 864 | 10.1107/S0108270193004950 | 0.71069 | Mo | null | 0.0604 | null | null | 0.073 | null | null | null | null | 1.43 | 1.43 | null | null | null | has coordinates | Place, H.; Willett, R.
Bis(4-aminopyridinium) hexabromodicuprate(II) diaquatetrabromodicopper(II)
Acta Crystallographica Section C
50(6)
(1994)
862-864 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,763 | 29.868 | 0.007 | 12.567 | 0.004 | 14.705 | 0.005 | 90 | null | 90 | null | 90 | null | 5,520 | 3 | 293 | null | null | null | null | null | null | null | 3 | P 21 21 2 | P 2 2ab | null | - C29 H43 O11 - | - C29 H39.5 O10.75 - | - C232 H316 O86 - | 8 | 2 | CD1053 | Hernández-Quiroz, T.; Soriano-García, M.; Rodríguez-Romero, A.; Valencia, C.; Hernández, L.; Aguirre-García, F. | [2α(2<i>S</i>,3<i>S</i>,4<i>R</i>,6<i>R</i>),3β,5α]-14-Hydroxy-19-oxo-3,2-[(tetrahydro-3,4-dihydroxy-6-methyl-2<i>H</i>-pyran-2,3-diyl)bis(oxy)]card-20(22)-enolide dihydrate (calactin), C~29~H~39~O~9~.2H~2~O, a cardenolide from <i>Asclepias linaria</i> | Acta Crystallographica Section C | 1,994 | 50 | 6 | 935 | 938 | 10.1107/S0108270193010790 | 1.5418 | CuKα | null | 0.064 | null | null | 0.081 | null | null | null | null | 1.21 | 1.21 | null | null | null | has coordinates | Hernández-Quiroz, T.; Soriano-García, M.; Rodríguez-Romero, A.; Valencia, C.; Hernández, L.; Aguirre-García, F.
[2α(2<i>S</i>,3<i>S</i>,4<i>R</i>,6<i>R</i>),3β,5α]-14-Hydroxy-19-oxo-3,2-[(tetrahydro-3,4-dihydroxy-6-methyl-2<i>H</i>-pyran-2,3-diyl)bis(oxy)]card-20(22)-enolide dihydrate (calactin), C~29~H~39~O~9~.2H~2~O,... | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,779 | 12.526 | 0.004 | 16.551 | 0.006 | 14.75 | 0.004 | 90 | null | 113.46 | 0.02 | 90 | null | 2,805.2 | 1.6 | 296.2 | null | 296.2 | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C50 H72 Ca2 N4 O20 - | - C50 H72 Ca2 N4 O20 - | - C100 H144 Ca4 N8 O40 - | 2 | 0.5 | Norikazu Ueyama; Jiro Takeda; Yusuke Yamada; Akira Onoda; Taka-aki Okamura; Akira Nakamura | Dinuclear Calcium Complexes with Intramolecularly NH...O Hydrogen-Bonded Dicarboxylate Ligands | Inorganic Chemistry | 1,999 | 38 | 475 | 478 | 10.1021/ic981055t | 0.7107 | MoKα | null | 0.0594 | null | null | 0.0688 | null | null | null | null | 1.843 | 1.843 | null | null | null | has coordinates | Norikazu Ueyama; Jiro Takeda; Yusuke Yamada; Akira Onoda; Taka-aki Okamura; Akira Nakamura
Dinuclear Calcium Complexes with Intramolecularly NH...O Hydrogen-Bonded Dicarboxylate Ligands
Inorganic Chemistry
38
(1999)
475-478 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,764 | 8.238 | 0.002 | 8.968 | 0.002 | 25.165 | 0.005 | 90 | null | 90 | null | 90 | null | 1,859.1 | 0.7 | 296 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C10 H11 N O - | - C10 H11 N O - | - C80 H88 N8 O8 - | 8 | 2 | CR1055 | Pollagi, T.P.; Geib, S.J.; Hopkins, M.D. | 2-Methyl-4-(4-pyridyl)-3-butyn-2-ol: a two-dimensional hydrogen-bond network | Acta Crystallographica Section C | 1,994 | 50 | 6 | 910 | 913 | 10.1107/S0108270193010455 | 1.54178 | CuKα | null | 0.0664 | null | null | 0.0971 | null | null | null | null | 1.11 | 1.11 | null | null | null | has coordinates | Pollagi, T.P.; Geib, S.J.; Hopkins, M.D.
2-Methyl-4-(4-pyridyl)-3-butyn-2-ol: a two-dimensional hydrogen-bond network
Acta Crystallographica Section C
50(6)
(1994)
910-913 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,765 | 7.0557 | 0.0007 | 7.0557 | 0.0007 | 12.9669 | 0.0009 | 90 | null | 90 | null | 120 | null | 559.05 | 0.09 | 296 | null | null | null | null | null | null | null | 5 | P 31 2 1 | P 31 2" | 152 | - H2 La Na O9 S2 - | - H2 La Na O10 S2 - | - H6 La3 Na3 O30 S6 - | 3 | 0.5 | CR1065 | Blackburn, A.C.; Gerkin, R.E. | Sodium lanthanum(III) sulfate monohydrate, NaLa(SO~4~)~2~.H~2~O | Acta Crystallographica Section C | 1,994 | 50 | 6 | 835 | 838 | 10.1107/S0108270193010066 | 0.71073 | MoKᾱ | null | 0.014 | null | null | 0.024 | null | null | null | null | 1.39 | 1.39 | null | null | null | has coordinates | Blackburn, A.C.; Gerkin, R.E.
Sodium lanthanum(III) sulfate monohydrate, NaLa(SO~4~)~2~.H~2~O
Acta Crystallographica Section C
50(6)
(1994)
835-838 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,766 | 13.764 | 0.005 | 7.787 | 0.007 | 18.047 | 0.009 | 90 | null | 92.83 | 0.03 | 90 | null | 1,932 | 2 | 298 | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C21 H27 N O4 - | - C21 H27 N O4 - | - C84 H108 N4 O16 - | 4 | 1 | CR1094 | Joseph, S.P.; Comins, D.L.; Singh, P. | An unusual C-4a hydroxylated decahydroquinolone | Acta Crystallographica Section C | 1,994 | 50 | 6 | 950 | 952 | 10.1107/S0108270193014404 | 0.71069 | MoKα | null | 0.048 | null | null | 0.05 | null | null | null | null | 1.4 | 1.4 | null | null | null | has coordinates | Joseph, S.P.; Comins, D.L.; Singh, P.
An unusual C-4a hydroxylated decahydroquinolone
Acta Crystallographica Section C
50(6)
(1994)
950-952 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,767 | 11.701 | 0.001 | 11.067 | 0.001 | 10.55 | 0.001 | 90 | null | 90 | null | 90 | null | 1,366.2 | 0.2 | 295 | null | null | null | null | null | null | null | 5 | C m c e | -C 2ac 2 | 64 | - Cl6 H12 N4 Pt Sn - | - Cl6 H12 N4 Pt Sn - | - Cl24 H48 N16 Pt4 Sn4 - | 4 | 0.25 | DU1058 | Garnier, E.; El Mouahid, A.; Černák, J. | Tetraammineplatinum(II) hexachlorostannate(IV), [Pt(NH~3~)~4~][SnCl~6~] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 845 | 847 | 10.1107/S0108270193011990 | 0.7093 | MoKα | null | 0.0361 | null | null | 0.0462 | null | null | null | null | 2.26 | 2.26 | null | null | null | has coordinates | Garnier, E.; El Mouahid, A.; Černák, J.
Tetraammineplatinum(II) hexachlorostannate(IV), [Pt(NH~3~)~4~][SnCl~6~]
Acta Crystallographica Section C
50(6)
(1994)
845-847 | 198,528 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,768 | 7.197 | 0.001 | 8.27 | 0.001 | 22.684 | 0.001 | 90 | null | 90 | null | 90 | null | 1,350.1 | 0.3 | 291 | null | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | null | - C12 H19 B N O2 P - | - C12 H19 B N O2 P - | - C48 H76 B4 N4 O8 P4 - | 4 | 1 | DU1059 | Brunel, J.M.; Buono, G.; Baldy, A.; Feneau-Dupont, J.; Declercq, J.P. | A (2<i>R</i>,5<i>S</i>)-2-<i>o</i>-anisyl-3-oxa-1-aza-2-phosphabicyclo[3.3.0]octane–borane complex | Acta Crystallographica Section C | 1,994 | 50 | 6 | 954 | 955 | 10.1107/S0108270193011606 | 1.5418 | CuKα | null | 0.054 | null | null | 0.057 | null | null | null | null | 0.6 | 0.6 | null | null | null | has coordinates | Brunel, J.M.; Buono, G.; Baldy, A.; Feneau-Dupont, J.; Declercq, J.P.
A (2<i>R</i>,5<i>S</i>)-2-<i>o</i>-anisyl-3-oxa-1-aza-2-phosphabicyclo[3.3.0]octane–borane complex
Acta Crystallographica Section C
50(6)
(1994)
954-955 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,778 | 13.594 | 0.001 | 23.177 | 0.002 | 16.351 | 0.001 | 90 | null | 104.59 | 0.01 | 90 | null | 4,985.6 | 0.7 | 173 | 2 | 173 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | magnesium tri(tert-butyl)silylphosphandiide | - C13 H28 Mg P Si - | - C13 H28 Mg P Si - | - C156 H336 Mg12 P12 Si12 - | 12 | 3 | Matthias Westerhausen; Mathias Krofta; Arno Pfitzner | Synthesis and Structure of Solvent-Free Hexameric Magnesium Tri(tert-butyl)silylphosphandiide | Inorganic Chemistry | 1,999 | 38 | 598 | 599 | 10.1021/ic9810485 | 0.71073 | MoKα | 0.0896 | 0.0756 | null | 0.2263 | 0.2139 | null | null | null | 1.062 | 1.122 | 1.122 | null | null | null | has coordinates,has disorder | Matthias Westerhausen; Mathias Krofta; Arno Pfitzner
Synthesis and Structure of Solvent-Free Hexameric Magnesium Tri(tert-butyl)silylphosphandiide
Inorganic Chemistry
38
(1999)
598-599 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,769 | 4.7833 | 0.0006 | 6.9698 | 0.0008 | 7.7644 | 0.0008 | 89.41 | 0.01 | 87.77 | 0.01 | 73.16 | 0.01 | 247.6 | 0.7 | 294 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - Cd O14 P4 V2 - | - Cd O14 P4 V2 - | - Cd O14 P4 V2 - | 1 | 0.5 | Boudin, S.; Grandin, A.; Leclaire, A.; Borel, M.M.; Raveau, B. | CdV~2~(P~2~O~7~)~2~ | Acta Crystallographica Section C | 1,994 | 50 | 840 | 842 | null | null | 0.021 | null | null | 0.022 | null | null | null | null | null | null | null | null | null | has coordinates | Boudin, S.; Grandin, A.; Leclaire, A.; Borel, M.M.; Raveau, B.
CdV~2~(P~2~O~7~)~2~
Acta Crystallographica Section C
50
(1994)
840-842 | 277,834 | 2022-09-14 | 16:39:43 | #------------------------------------------------------------------------------
#$Date: 2022-09-14 19:38:48 +0300 (Wed, 14 Sep 2022) $
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2,009,770 | 9.369 | 0.001 | 10.762 | 0.003 | 11.51 | 0.001 | 76.31 | 0.01 | 72.18 | 0.01 | 64.14 | 0.02 | 987 | 0.3 | 295 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C18 H29 N5 O3 - | - C18 H28 N5 O3 - | - C36 H56 N10 O6 - | 2 | 1 | HA1054 | Velmurugan, D.; Govindasamy, L.; Subramanian, E.; Rajendran, T.M.; Kandaswamy, M. | 2,6-Bis[(4-methyl-1-piperazinyl)methyl]-4-nitrophenol | Acta Crystallographica Section C | 1,994 | 50 | 6 | 931 | 933 | 10.1107/S0108270193010273 | 1.5418 | CuKα | null | 0.058 | null | null | 0.073 | null | null | null | null | 0.574 | 0.574 | null | null | null | has coordinates | Velmurugan, D.; Govindasamy, L.; Subramanian, E.; Rajendran, T.M.; Kandaswamy, M.
2,6-Bis[(4-methyl-1-piperazinyl)methyl]-4-nitrophenol
Acta Crystallographica Section C
50(6)
(1994)
931-933 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,771 | 11.426 | 0.001 | 16.09 | 0.001 | 11.359 | 0.001 | 90 | null | 118.37 | 0.01 | 90 | null | 1,837.5 | 0.3 | 296 | null | null | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | 14 | - C18 H21 N5 O3 S - | - C22 H17 N5 O3 S2 - | - C88 H68 N20 O12 S8 - | 4 | 1 | HA1059 | Das, A. K.; Datta, M.; Mazumdar, S. K.; Bhaumik, G.; Mazumdar, B.; Talapatra, S. K. | 2,3-Dihydro-6-hydroxy-1,3-dimethyl-7-propyl-9-(2-thienylmethyl)pyrimido[2,1-<i>f</i>]purine-4,8(1<i>H</i>,9<i>H</i>)-dione | Acta Crystallographica Section C | 1,994 | 50 | 6 | 952 | 954 | 10.1107/S0108270193011461 | 1.54178 | CuKα | null | 0.068 | null | null | 0.068 | null | null | null | null | 1.03 | 1.03 | null | null | null | has coordinates | Das, A. K.; Datta, M.; Mazumdar, S. K.; Bhaumik, G.; Mazumdar, B.; Talapatra, S. K.
2,3-Dihydro-6-hydroxy-1,3-dimethyl-7-propyl-9-(2-thienylmethyl)pyrimido[2,1-<i>f</i>]purine-4,8(1<i>H</i>,9<i>H</i>)-dione
Acta Crystallographica Section C
50(6)
(1994)
952-954 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,772 | 7.437 | 0.003 | 13.176 | 0.004 | 6.21 | 0.002 | 92 | 0.03 | 96.9 | 0.03 | 91.76 | 0.03 | 603.4 | 0.4 | 296 | null | 296 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | N-(pentafluorobenzylidine)-p-methylaniline | - C14 H8 F5 N - | - C14 H8 F5 N - | - C28 H16 F10 N2 - | 2 | 1 | HA1078 | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E. | <i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four molecules representing key stages in the one-pot synthesis of 1,2,3,4-tetrafluoroacridines by treating pent... | Acta Crystallographica Section C | 1,994 | 50 | 6 | 967 | 971 | 10.1107/S010827019400003X | 0.71069 | MoKα | null | 0.042 | null | null | 0.0461 | null | null | null | null | 1.75 | 1.75 | null | null | null | has coordinates | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E.
<i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four mole... | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,777 | 21.224 | 0.005 | 10.7537 | 0.0008 | 22.723 | 0.005 | 90 | null | 116.76 | 0.01 | 90 | null | 4,630.8 | 1.6 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P 1 21 1 | P 2yb | 4 | - C18 H37 Co Fe N11 Na O4 - | - C18 H29 Co Fe N11 Na O4 - | - C108 H174 Co6 Fe6 N66 Na6 O24 - | 6 | 3 | Paul V. Bernhardt; Manuel Martinez | The First Structurally Characterized Discrete Dinuclear μ-Cyano Hexacyanoferrate Complex | Inorganic Chemistry | 1,999 | 38 | 424 | 425 | 10.1021/ic981019u | 0.71073 | MoKα | 0.1928 | 0.0923 | null | 0.3227 | 0.2453 | null | null | null | 1.017 | 1.155 | 1.155 | null | null | null | has coordinates | Paul V. Bernhardt; Manuel Martinez
The First Structurally Characterized Discrete Dinuclear μ-Cyano Hexacyanoferrate Complex
Inorganic Chemistry
38
(1999)
424-425 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,773 | 7.366 | 0.007 | 12.411 | 0.002 | 6.312 | 0.002 | 100.13 | 0.02 | 94.28 | 0.05 | 86.69 | 0.04 | 565.9 | 0.6 | 295 | null | 22 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | 1,2,3,4-tetrafluoro-7-ethoxyacridine | - C14 H7 F4 N O - | - C14 H7 F4 N O - | - C28 H14 F8 N2 O2 - | 2 | 1 | HA1078 | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E. | <i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four molecules representing key stages in the one-pot synthesis of 1,2,3,4-tetrafluoroacridines by treating pent... | Acta Crystallographica Section C | 1,994 | 50 | 6 | 967 | 971 | 10.1107/S010827019400003X | 1.5418 | CuKα | null | 0.0779 | null | null | 0.0883 | null | null | null | null | 3.237 | 3.237 | null | null | null | has coordinates | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E.
<i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four mole... | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,776 | 13.126 | 0.001 | 14.355 | 0.005 | 8.472 | 0.001 | 90 | null | 90 | null | 90 | null | 1,596.3 | 0.6 | 198 | null | 198 | null | null | null | null | null | 5 | P n m a | -P 2ac 2n | 62 | - C6 H22 B10 O Si2 - | - C6 H22 B10 O Si2 - | - C24 H88 B40 O4 Si8 - | 4 | 0.5 | Francis M. de Rege; Jeremy D. Kassebaum; Brian L. Scott; Kent D. Abney; Gary J. Balaich | Synthesis, Structure, and Reactivity of 1,2-(1',1',2',2'-Tetramethyldisilane-1',2')carborane | Inorganic Chemistry | 1,999 | 38 | 486 | 489 | 10.1021/ic980992y | 0.71073 | MoKα | 0.0731 | 0.0448 | null | 0.1181 | 0.1054 | null | null | null | 1.162 | 1.244 | 1.244 | null | null | null | has coordinates | Francis M. de Rege; Jeremy D. Kassebaum; Brian L. Scott; Kent D. Abney; Gary J. Balaich
Synthesis, Structure, and Reactivity of 1,2-(1',1',2',2'-Tetramethyldisilane-1',2')carborane
Inorganic Chemistry
38
(1999)
486-489 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
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2,009,774 | 8.27 | 0.005 | 10.721 | 0.005 | 5.995 | 0.002 | 102.56 | 0.03 | 92.6 | 0.04 | 83.3 | 0.03 | 515.2 | 0.4 | 296 | null | 296 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | 1,2,3,4,7-pentafluoroacridine | - C13 H4 F5 N - | - C13 H4 F5 N - | - C26 H8 F10 N2 - | 2 | 1 | HA1078 | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E. | <i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four molecules representing key stages in the one-pot synthesis of 1,2,3,4-tetrafluoroacridines by treating pent... | Acta Crystallographica Section C | 1,994 | 50 | 6 | 967 | 971 | 10.1107/S010827019400003X | 0.71069 | MoKα | null | 0.0447 | null | null | 0.0531 | null | null | null | null | 2.145 | 2.145 | null | null | null | has coordinates | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E.
<i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four mole... | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,775 | 6.92 | 0.005 | 8.797 | 0.005 | 7.053 | 0.002 | 90 | null | 115.49 | 0.03 | 90 | null | 387.6 | 0.4 | 200 | null | 200 | null | null | null | null | null | 4 | P 1 2/m 1 | -P 2y | 10 | - C6 H22 B10 Si2 - | - C6 H22 B10 Si2 - | - C6 H22 B10 Si2 - | 1 | 0.25 | Francis M. de Rege; Jeremy D. Kassebaum; Brian L. Scott; Kent D. Abney; Gary J. Balaich | Synthesis, Structure, and Reactivity of 1,2-(1',1',2',2'-Tetramethyldisilane-1',2')carborane | Inorganic Chemistry | 1,999 | 38 | 486 | 489 | 10.1021/ic980992y | 0.71073 | MoKα | 0.1261 | 0.064 | null | 0.1443 | 0.1189 | null | null | null | 1.088 | 1.248 | 1.248 | null | null | null | has coordinates | Francis M. de Rege; Jeremy D. Kassebaum; Brian L. Scott; Kent D. Abney; Gary J. Balaich
Synthesis, Structure, and Reactivity of 1,2-(1',1',2',2'-Tetramethyldisilane-1',2')carborane
Inorganic Chemistry
38
(1999)
486-489 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
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2,009,775 | 5.871 | 0.004 | 7.889 | 0.003 | 34.83 | 0.009 | 90 | null | 91.23 | 0.04 | 90 | null | 1,612.8 | 1.3 | 296 | null | 296 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 3-p-methylanilino-1,2,4-trifluoro-7-methylacridine | - C21 H15 F3 N2 - | - C21 H15 F3 N2 - | - C84 H60 F12 N8 - | 4 | 1 | HA1078 | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E. | <i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four molecules representing key stages in the one-pot synthesis of 1,2,3,4-tetrafluoroacridines by treating pent... | Acta Crystallographica Section C | 1,994 | 50 | 6 | 967 | 971 | 10.1107/S010827019400003X | 0.71069 | MoKα | null | 0.0683 | null | null | 0.0662 | null | null | null | null | 4.253 | 4.253 | null | null | null | has coordinates | Adamson, A.J.; Archambeau, Y.; Banks, R.E.; Beagley, B.; Helliwell, M.; Pritchard, R.G.; Tipping, A.E.
<i>p</i>-Methyl-<i>N</i>-(pentafluorobenzylidene)aniline (1), 1,2,3,4-tetrafluoro-7-methoxyacridine (2), 1,2,3,4,7-pentafluoroacridine (3) and 3-(<i>p</i>-methylanilino)-1,2,4-trifluoro-7-methylacridine (4): four mole... | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,776 | 13.322 | 0.004 | 5.367 | 0.002 | 16.266 | 0.005 | 90 | null | 112.88 | 0.02 | 90 | null | 1,071.5 | 0.6 | 160 | 1 | 160 | 1 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | benzyl 2(S)-[(tert-butoxycarbonyl)amino]-4-oxo-6-phenyl-(E)-hex-5-enoate | - C24 H27 N O5 - | - C24 H27 N O5 - | - C48 H54 N2 O10 - | 2 | 1 | HA1079 | Clegg, William; Jackson, Richard F.W.; O'Neil, Paul A.; Wishart, Neil | An enantiomerically pure 4-oxo-α-amino acid derivative | Acta Crystallographica Section C | 1,994 | 50 | 6 | 965 | 967 | 10.1107/S0108270194000041 | 0.71073 | MoKα | 0.0506 | 0.0341 | null | 0.0924 | 0.0822 | null | null | null | 1.062 | 1.048 | 1.048 | null | null | null | has coordinates | Clegg, William; Jackson, Richard F.W.; O'Neil, Paul A.; Wishart, Neil
An enantiomerically pure 4-oxo-α-amino acid derivative
Acta Crystallographica Section C
50(6)
(1994)
965-967 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,777 | 7.7221 | 0.0008 | 14.915 | 0.002 | 11.8191 | 0.0014 | 90 | null | 95.351 | 0.009 | 90 | null | 1,355.3 | 0.3 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | Diphenyl(4-pyridyl)methanol | Diphenyl(4-pyridyl)methanol | - C18 H15 N O - | - C18 H15 N O - | - C72 H60 N4 O4 - | 4 | 1 | HA1086 | Glidewell, Christopher; Ferguson, George | Molecules isoelectronic with triphenylmethanol: diphenyl(4-pyridyl)methanol and triphenylmethylamine | Acta Crystallographica Section C | 1,994 | 50 | 6 | 924 | 928 | 10.1107/S0108270193014209 | 0.71067 | MoKα | 0.141 | 0.043 | null | 0.065 | 0.049 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Glidewell, Christopher; Ferguson, George
Molecules isoelectronic with triphenylmethanol: diphenyl(4-pyridyl)methanol and triphenylmethylamine
Acta Crystallographica Section C
50(6)
(1994)
924-928 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,778 | 6.0541 | 0.0005 | 13.4943 | 0.0013 | 17.603 | 0.002 | 90 | null | 90 | null | 90 | null | 1,438.1 | 0.2 | 293 | null | 293 | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | triphenylmethylamine | Triphenylmethylamine | - C19 H17 N - | - C19 H17 N - | - C76 H68 N4 - | 4 | 1 | HA1086 | Glidewell, Christopher; Ferguson, George | Molecules isoelectronic with triphenylmethanol: diphenyl(4-pyridyl)methanol and triphenylmethylamine | Acta Crystallographica Section C | 1,994 | 50 | 6 | 924 | 928 | 10.1107/S0108270193014209 | 0.71067 | MoKα | 0.053 | 0.029 | null | 0.046 | 0.044 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Glidewell, Christopher; Ferguson, George
Molecules isoelectronic with triphenylmethanol: diphenyl(4-pyridyl)methanol and triphenylmethylamine
Acta Crystallographica Section C
50(6)
(1994)
924-928 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,774 | 18.03 | 0.001 | 14.5108 | 0.0007 | 23.221 | 0.001 | 90 | null | 112.778 | 0.004 | 90 | null | 5,601.5 | 0.5 | 213 | 2 | 213 | 2 | null | null | null | null | synthesized | 5 | P 1 21/n 1 | -P 2yn | 14 | Bis(μ2-bis(diphenylphosphino)methane-P,P')-tetrachloro- -di-molybdenum(II), dichloromethane solvate | - C52 H48 Cl8 Mo2 P4 - | - C52 H44 Cl8 Mo2 P4 - | - C208 H176 Cl32 Mo8 P16 - | 4 | 1 | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero | Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4 | Inorganic Chemistry | 1,999 | 38 | 490 | 495 | 10.1021/ic980972w | 0.71073 | MoKα | 0.0624 | 0.058 | null | 0.1657 | 0.1587 | null | null | null | 1.102 | 1.107 | 1.107 | null | null | null | has coordinates,has disorder | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero
Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4
Inorganic Chemistry
38
(1999)
490-495 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
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2,009,779 | 7.149 | 0.002 | 12.1026 | 0.0011 | 7.8726 | 0.0008 | 90 | null | 99.54 | 0.02 | 90 | null | 671.7 | 0.2 | 293 | null | 293 | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 2,2'-dimethoxydibenzyl | - C16 H18 O2 - | - C16 H18 O2 - | - C32 H36 O4 - | 2 | 0.5 | HA1088 | Ross, Jennifer-Nicola; Wardell, James; Ferguson, George; Low, John N | 2,2'-Dimethoxybibenzyl | Acta Crystallographica Section C | 1,994 | 50 | 6 | 976 | 977 | 10.1107/S0108270193014544 | 0.7093 | MoKα | 0.066 | 0.044 | null | 0.072 | 0.069 | null | null | null | null | 2.11 | 2.11 | null | null | null | has coordinates | Ross, Jennifer-Nicola; Wardell, James; Ferguson, George; Low, John N
2,2'-Dimethoxybibenzyl
Acta Crystallographica Section C
50(6)
(1994)
976-977 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,780 | 13.34 | 0.002 | 10.109 | 0.002 | 17.589 | 0.003 | 90 | null | 90 | null | 90 | null | 2,371.9 | 0.7 | 294 | null | null | null | null | null | null | null | 5 | P b c n | null | - C26 H16 Mn N6 S2 - | - C26 H16 Mn N6 S2 - | - C104 H64 Mn4 N24 S8 - | 4 | 0.5 | HH1078 | Holleman, Susan R.; Parker, O. Jerry; Breneman, Gary L. | <i>cis</i>-Diisothiocyanatobis(1,10-phenanthroline)manganese(II), [Mn(NCS)~2~(C~12~H~8~N~2~)~2~] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 867 | 869 | 10.1107/S0108270193012892 | 0.71073 | MoKα | null | 0.036 | null | null | 0.043 | null | null | null | null | 1.52 | 1.52 | null | null | null | has coordinates | Holleman, Susan R.; Parker, O. Jerry; Breneman, Gary L.
<i>cis</i>-Diisothiocyanatobis(1,10-phenanthroline)manganese(II), [Mn(NCS)~2~(C~12~H~8~N~2~)~2~]
Acta Crystallographica Section C
50(6)
(1994)
867-869 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,781 | 15.743 | 0.005 | 57.01 | 0.03 | 3.962 | 0.001 | 90 | null | 90 | null | 90 | null | 3,556 | 2 | 296 | null | null | null | null | null | null | null | 6 | F d d 2 | F 2 -2d | 43 | - C12 H12 Br2 Cd N4 O6 - | - C12 H12 Br2 Cd N4 O6 - | - C96 H96 Br16 Cd8 N32 O48 - | 8 | 0.5 | HL1040 | Hu, S.-Z.; Shi, D.-S.; Huang, Y.-Q.; Li, S.-X.; Yang, Y.-C. | A 1:2 addition compound of cadmium bromide with 3-methyl-4-nitropyridine <i>N</i>-oxide | Acta Crystallographica Section C | 1,994 | 50 | 6 | 893 | 895 | 10.1107/S0108270193011473 | 0.71073 | MoKα | null | 0.036 | null | null | 0.038 | null | null | null | null | 1.208 | 1.208 | null | null | null | has coordinates | Hu, S.-Z.; Shi, D.-S.; Huang, Y.-Q.; Li, S.-X.; Yang, Y.-C.
A 1:2 addition compound of cadmium bromide with 3-methyl-4-nitropyridine <i>N</i>-oxide
Acta Crystallographica Section C
50(6)
(1994)
893-895 | 277,834 | 2022-09-14 | 16:39:43 | #------------------------------------------------------------------------------
#$Date: 2022-09-14 19:38:48 +0300 (Wed, 14 Sep 2022) $
#$Revision: 277834 $
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2,009,782 | 11.045 | 0.003 | 21.031 | 0.003 | 23.151 | 0.003 | 102.99 | 0.02 | 102.47 | 0.02 | 103.06 | 0.02 | 4,898.9 | 1.9 | 298 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C54 H44 Ir N3 O2 P4 - | - C54 H44 Ir N3 O2 P4 - | - C216 H176 Ir4 N12 O8 P16 - | 4 | 2 | HU1055 | Wang, J.-C.; Chou, L.-Y.; Hsien, W.-Y.; Liu, L.-K. | [Ir(dppm)~2~(O~2~)](C~4~N~3~) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 879 | 882 | 10.1107/S0108270193010923 | 0.71073 | MoKα | null | 0.057 | null | null | 0.07 | null | null | null | null | 1.816 | 1.816 | null | null | null | has coordinates | Wang, J.-C.; Chou, L.-Y.; Hsien, W.-Y.; Liu, L.-K.
[Ir(dppm)~2~(O~2~)](C~4~N~3~)
Acta Crystallographica Section C
50(6)
(1994)
879-882 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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#$Revision: 278247 $
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2,009,783 | 13.488 | 0.006 | 13.488 | 0.006 | 65.5 | 0.03 | 90 | null | 90 | null | 120 | null | 10,320 | 8 | 108 | 2 | 108 | 2 | null | null | null | null | 7 | R -3 c :H | -R 3 2"c | 167 | (μ~3~-iodo)(μ~3~-tetraselenidotungstide)tris(dimethylphenylphosphinesilver) | - C24 H33 Ag3 I P3 Se4 W - | - C24 H33 Ag3 I P3 Se4 W - | - C288 H396 Ag36 I12 P36 Se48 W12 - | 12 | 0.333333 | HU1076 | Ansari, Mohammad A.; Bollinger, John C.; Christuk, Christopher C.; Ibers, James A. | Synthesis and structure of [(μ~3~-I)(μ~3~-WSe~4~){Ag(PMe~2~Ph)}~3~] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 869 | 871 | 10.1107/S0108270193012338 | 0.7093 | MoKα~1~ | 0.074 | 0.05 | null | 0.129 | 0.121 | null | null | null | 1.35 | 1.47 | 1.47 | null | null | null | has coordinates | Ansari, Mohammad A.; Bollinger, John C.; Christuk, Christopher C.; Ibers, James A.
Synthesis and structure of [(μ~3~-I)(μ~3~-WSe~4~){Ag(PMe~2~Ph)}~3~]
Acta Crystallographica Section C
50(6)
(1994)
869-871 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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#$Revision: 176759 $
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2,009,784 | 6.562 | 0.001 | 13.583 | 0.003 | 22.488 | 0.004 | 90 | null | 90 | null | 90 | null | 2,004.4 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | 3-methoxy-16,16-dimethyl-5α-andrstan-17-one | - C22 H36 O2 - | - C22 H36 O2 - | - C88 H144 O8 - | 4 | 1 | KA1056 | Wölfling, János; Schneider, Gyula; Noltemeyer, Mathias; Tietze, Lutz F. | 3-Methoxy-16,16-dimethyl-5α-androstan-17-one | Acta Crystallographica Section C | 1,994 | 50 | 6 | 964 | 965 | 10.1107/S0108270193012557 | 0.71072 | MoKα | 0.0445 | 0.0363 | null | 0.1105 | 0.096 | null | null | null | 1.037 | 0.968 | 0.968 | null | null | null | has coordinates | Wölfling, János; Schneider, Gyula; Noltemeyer, Mathias; Tietze, Lutz F.
3-Methoxy-16,16-dimethyl-5α-androstan-17-one
Acta Crystallographica Section C
50(6)
(1994)
964-965 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,773 | 12.699 | 0.002 | 12.699 | 0.002 | 16.015 | 0.004 | 90 | null | 90 | null | 90 | null | 2,582.7 | 0.9 | 173 | 2 | 173 | 2 | null | null | null | null | synthesized | 5 | I -4 | I -4 | 82 | Bis(μ2-bis(dimethylphosphino)methane-P,P')-tetrachloro- -di-molybdenum(II), hexane solvate | - C13 H35 Cl4 Mo2 P4 - | - C13 H35 Cl4 Mo2 P4 - | - C52 H140 Cl16 Mo8 P16 - | 4 | 0.5 | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero | Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4 | Inorganic Chemistry | 1,999 | 38 | 490 | 495 | 10.1021/ic980972w | 0.71073 | MoKα | 0.0496 | 0.0308 | null | 0.0866 | 0.0785 | null | null | null | 1.053 | 1.102 | 1.102 | null | null | null | has coordinates | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero
Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4
Inorganic Chemistry
38
(1999)
490-495 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
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2,009,785 | 4.733 | 0.001 | 17.305 | 0.001 | 19.243 | 0.001 | 90 | null | 90 | null | 90 | null | 1,576.1 | 0.4 | 293 | null | null | null | null | null | null | null | 7 | P 21 21 21 | P 2ac 2ab | null | - C9 H13.5 Br N3 Na O9.25 P - | - C9 H11 Br N3 Na O11 P - | - C36 H44 Br4 N12 Na4 O44 P4 - | 4 | 1 | LI1008 | Mande, S.S.; Seshadri, T.P.; Viswamitra, M.A. | Effects of halogen substitution in nucleic acid components. Structure of sodium 5-bromocytidine 5'-phosphate hydrate | Acta Crystallographica Section C | 1,994 | 50 | 6 | 876 | 879 | 10.1107/S010827019300945X | 1.5418 | Cu | null | 0.044 | null | null | 0.049 | null | null | null | null | 0.62 | 0.62 | null | null | null | has coordinates | Mande, S.S.; Seshadri, T.P.; Viswamitra, M.A.
Effects of halogen substitution in nucleic acid components. Structure of sodium 5-bromocytidine 5'-phosphate hydrate
Acta Crystallographica Section C
50(6)
(1994)
876-879 | 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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2,009,786 | 8.674 | 0.001 | 13.293 | 0.001 | 12.67 | 0.003 | 90 | null | 92.55 | 0.02 | 90 | null | 1,459.4 | 0.4 | 292 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C15 H15 N O5 - | - C15 H15 N O5 - | - C60 H60 N4 O20 - | 4 | 1 | LI1067 | Zukerman-Schpector, J.; Pinto, A.Da.C.; Da Silva, J.F.M.; Barcellos, M.T.F.C.; Pires, S.S.; Fraiz, S.V. Jr | Diethyl (2,3-dihydro-2-oxo-3-indolylidene)propanedioate | Acta Crystallographica Section C | 1,994 | 50 | 6 | 945 | 946 | 10.1107/S0108270193011369 | 0.71073 | MoKα | null | 0.06 | null | null | 0.067 | null | null | null | null | 2.06 | 2.06 | null | null | null | has coordinates | Zukerman-Schpector, J.; Pinto, A.Da.C.; Da Silva, J.F.M.; Barcellos, M.T.F.C.; Pires, S.S.; Fraiz, S.V. Jr
Diethyl (2,3-dihydro-2-oxo-3-indolylidene)propanedioate
Acta Crystallographica Section C
50(6)
(1994)
945-946 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$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/2/00/97/2009786.cif $
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2,009,787 | 10.257 | 0.003 | 16.941 | 0.007 | 14.13 | 0.007 | 90 | null | 90 | null | 90 | null | 2,455.3 | 1.7 | 293 | null | null | null | null | null | null | null | 6 | P b c a | -P 2ac 2ab | 61 | - C H7 Ga3 N O13 P3 - | - C H6 Ga3 N O13 P3 - | - C8 H48 Ga24 N8 O104 P24 - | 8 | 1 | LI1069 | Glasser, F.P.; Howie, R.A.; Kan, Q. | Methylammonium tris(galliophosphate)hydroxide | Acta Crystallographica Section C | 1,994 | 50 | 6 | 848 | 850 | 10.1107/S0108270193011163 | 0.71005 | MoKα | null | 0.031 | null | null | 0.057 | null | null | null | null | 1.0561 | 1.0561 | null | null | null | has coordinates | Glasser, F.P.; Howie, R.A.; Kan, Q.
Methylammonium tris(galliophosphate)hydroxide
Acta Crystallographica Section C
50(6)
(1994)
848-850 | 192,203 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-02-17 03:42:24 +0200 (Fri, 17 Feb 2017) $
#$Revision: 192203 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/97/2009787.cif $
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2,009,788 | 5.9826 | 0.0009 | 10.1528 | 0.0007 | 21.785 | 0.003 | 90 | null | 90 | null | 90 | null | 1,323.2 | 0.3 | 293 | null | 293 | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | 1-Ferrocenyl-2,2-methylpropan-1-ol | 1-Ferrocenyl-2,2-methylpropan-1-ol #93-28cg C~5~H~5~-Fe-C~5~H~4~-CH(OH)-t-Bu | - C15 H20 Fe O - | - C15 H20 Fe O - | - C60 H80 Fe4 O4 - | 4 | 1 | LI1086 | Li, Yiwei; Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M. | Hydrogen bonding in ferrocene derivatives: structures of 1-ferrocenyl-2,2-dimethylpropan-1-ol and 2,2'-(1,1'-ferrocenediyl)di(propan-2-ol) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 857 | 861 | 10.1107/S0108270193013654 | 0.71067 | MoKα | 0.056 | 0.032 | null | 0.046 | 0.04 | null | null | null | null | 0.99 | 0.99 | null | null | null | has coordinates,has disorder | Li, Yiwei; Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M.
Hydrogen bonding in ferrocene derivatives: structures of 1-ferrocenyl-2,2-dimethylpropan-1-ol and 2,2'-(1,1'-ferrocenediyl)di(propan-2-ol)
Acta Crystallographica Section C
50(6)
(1994)
857-861 | 190,523 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-01-14 22:33:54 +0200 (Sat, 14 Jan 2017) $
#$Revision: 190523 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/97/2009788.cif $
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2,009,789 | 7.1486 | 0.0004 | 12.4464 | 0.0008 | 16.4802 | 0.0009 | 90 | null | 97.609 | 0.004 | 90 | null | 1,453.4 | 0.15 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 2,2'-(Ferrocene-1,1'-diyl)di(propan-2-ol) | 2,2'-(Ferrocene-1,1'-diyl)di(propan-2-ol) # Fe[C~5~H~4~-CMe~2~-OH]2 | - C16 H22 Fe O2 - | - C16 H22 Fe O2 - | - C64 H88 Fe4 O8 - | 4 | 1 | LI1086 | Li, Yiwei; Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M. | Hydrogen bonding in ferrocene derivatives: structures of 1-ferrocenyl-2,2-dimethylpropan-1-ol and 2,2'-(1,1'-ferrocenediyl)di(propan-2-ol) | Acta Crystallographica Section C | 1,994 | 50 | 6 | 857 | 861 | 10.1107/S0108270193013654 | 0.710069 | MoKα | 0.031 | 0.026 | null | 0.045 | 0.044 | null | null | null | null | 1.64 | 1.64 | null | null | null | has coordinates | Li, Yiwei; Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M.
Hydrogen bonding in ferrocene derivatives: structures of 1-ferrocenyl-2,2-dimethylpropan-1-ol and 2,2'-(1,1'-ferrocenediyl)di(propan-2-ol)
Acta Crystallographica Section C
50(6)
(1994)
857-861 | 190,440 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-01-12 15:32:32 +0200 (Thu, 12 Jan 2017) $
#$Revision: 190440 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/97/2009789.cif $
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4,321,772 | 12.396 | 0.001 | 12.396 | 0.001 | 21.96 | 0.002 | 90 | null | 90 | null | 120 | null | 2,922.3 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | synthesized | 5 | P 64 2 2 | P 64 2 (0 0 2) | 181 | Tetrachloro-tetrakis(bis(dimethylphosphino)methane-P)- -di-molybdenum(II) | - C20 H56 Cl4 Mo2 P8 - | - C20 H56 Cl4 Mo2 P8 - | - C60 H168 Cl12 Mo6 P24 - | 3 | 0.25 | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero | Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4 | Inorganic Chemistry | 1,999 | 38 | 490 | 495 | 10.1021/ic980972w | 1.54184 | CuKα | 0.0373 | 0.0335 | null | 0.0918 | 0.0891 | null | null | null | 1.088 | 1.096 | 1.096 | null | null | null | has coordinates | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero
Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4
Inorganic Chemistry
38
(1999)
490-495 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/17/4321772.cif $
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2,009,790 | 9.333 | 0.011 | 9.183 | 0.008 | 9.162 | 0.007 | 88.45 | 0.06 | 102.57 | 0.02 | 93.76 | 0.04 | 764.7 | 1.3 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P -1 | -P 1 | 2 | AlPO4-CHA | - C4 H10 Al3 F N O13 P3 - | - C4 H10 Al3 F N O13 P3 - | - C8 H20 Al6 F2 N2 O26 P6 - | 2 | 1 | LI1095 | Harding, Marjorie M.; Kariuki, B. M. | Microcrystal structure determination of AlPO~4~-CHA using synchrotron radiation | Acta Crystallographica Section C | 1,994 | 50 | 6 | 852 | 854 | 10.1107/S0108270194000326 | 0.895 | Synchrotron | 0.1388 | 0.0806 | null | 0.2097 | 0.1889 | null | null | null | 0.838 | 1.144 | 1.144 | null | null | null | has coordinates | Harding, Marjorie M.; Kariuki, B. M.
Microcrystal structure determination of AlPO~4~-CHA using synchrotron radiation
Acta Crystallographica Section C
50(6)
(1994)
852-854 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/97/2009790.cif $
#-------------------------------------------------------------------... | ||||||||||
2,009,791 | 7.871 | 0.007 | 10.233 | 0.004 | 13.318 | 0.002 | 90 | null | 102.4 | 0.09 | 90 | null | 1,047.7 | 1.1 | 298 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C6 H10 N4 O6 Zn - | - C6 H10 N4 O6 Zn - | - C24 H40 N16 O24 Zn4 - | 4 | 1 | MU1067 | Menabue, L.; Saladini, M. | <i>catena</i>-Poly[zinc(II)-bis{μ-(<i>N</i>-carbamoylglycinato)}-<i>O</i>:<i>O</i>'';<i>O</i>'':<i>O</i>], [Zn(C~3~H~5~N~2~O~3~)~2~] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 887 | 889 | 10.1107/S0108270193011564 | 0.71069 | MoKα | null | 0.048 | null | null | 0.048 | null | null | null | null | null | null | null | null | null | has coordinates | Menabue, L.; Saladini, M.
<i>catena</i>-Poly[zinc(II)-bis{μ-(<i>N</i>-carbamoylglycinato)}-<i>O</i>:<i>O</i>'';<i>O</i>'':<i>O</i>], [Zn(C~3~H~5~N~2~O~3~)~2~]
Acta Crystallographica Section C
50(6)
(1994)
887-889 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/97/2009791.cif $
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2,009,792 | 36.378 | 0.007 | 15.89 | 0.003 | 12.115 | 0.002 | 90 | null | 102.07 | 0.03 | 90 | null | 6,848 | 2 | 298 | null | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | null | - C36 H25 Cl2 Fe N6 O9 - | - C36 H24 Cl1.5 Fe N6 O8.25 - | - C288 H192 Cl12 Fe8 N48 O66 - | 8 | 1 | MU1068 | Koh, L. L.; Xu, Y.; Hsieh, A. K.; Song, B.; Wu, F.; Liangnian, J. | Tris(1,10-phenanthroline)iron(II) diperchlorate hemihydrate | Acta Crystallographica Section C | 1,994 | 50 | 6 | 884 | 886 | 10.1107/S0108270193011618 | 0.71073 | MoKα | null | 0.08 | null | null | 0.081 | null | null | null | null | 1.71 | 1.71 | null | null | null | has coordinates | Koh, L. L.; Xu, Y.; Hsieh, A. K.; Song, B.; Wu, F.; Liangnian, J.
Tris(1,10-phenanthroline)iron(II) diperchlorate hemihydrate
Acta Crystallographica Section C
50(6)
(1994)
884-886 | 191,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-02-10 18:21:58 +0200 (Fri, 10 Feb 2017) $
#$Revision: 191977 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/97/2009792.cif $
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2,009,793 | 12.027 | 0.002 | 24.22 | 0.007 | 13.904 | 0.005 | 90 | null | 92.02 | 0.02 | 90 | null | 4,048 | 2 | 298 | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C39 H63 Cl Li Nd O3 - | - C39 H63 Cl Li Nd O3 - | - C156 H252 Cl4 Li4 Nd4 O12 - | 4 | 1 | MU1076 | Guan, J.; Shen, Q.; Jin, S.; Lin, Y. | Tris(<i>tert</i>-butylcyclopentadienyl)neodymium-μ-chloro-tris(tetrahydrofuran)lithium, [Nd(η^5^-^<i>t^</i>BuCp)~3~(μ-Cl)Li(thf)~3~] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 891 | 893 | 10.1107/S010827019301193X | 0.71069 | MoKα | null | 0.038 | null | null | 0.036 | null | null | null | null | 1.48366 | 1.48366 | null | null | null | has coordinates | Guan, J.; Shen, Q.; Jin, S.; Lin, Y.
Tris(<i>tert</i>-butylcyclopentadienyl)neodymium-μ-chloro-tris(tetrahydrofuran)lithium, [Nd(η^5^-^<i>t^</i>BuCp)~3~(μ-Cl)Li(thf)~3~]
Acta Crystallographica Section C
50(6)
(1994)
891-893 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
#$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/2/00/97/2009793.cif $
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2,009,794 | 8.856 | 0.001 | 8.856 | 0.001 | 7.017 | 0.002 | 90 | null | 90 | null | 120 | null | 476.6 | 0.16 | 113 | 1 | 113 | 1 | null | null | null | null | 6 | P -3 m 1 | null | Litium bis(tetramethylammonium) hexanitrocobaltate(III) | - C8 H24 Co Li N8 O12 - | - C8 H24 Co Li N8 O12 - | - C8 H24 Co Li N8 O12 - | 1 | 0.083333 | MU1078 | Adovasio, Victor; Lina, Fausto; Nardelli, Mario; Pelizzi, Giancarlo | Lithium bis(tetramethyllammonium) hexanitrocobaltate(III) at 113 and 293 K | Acta Crystallographica Section C | 1,994 | 50 | 6 | 871 | 874 | 10.1107/S0108270193011588 | 0.71069 | MoKαmean | null | 0.0292 | null | null | 0.0765 | null | null | null | null | 1.082 | 1.082 | null | null | null | has coordinates | Adovasio, Victor; Lina, Fausto; Nardelli, Mario; Pelizzi, Giancarlo
Lithium bis(tetramethyllammonium) hexanitrocobaltate(III) at 113 and 293 K
Acta Crystallographica Section C
50(6)
(1994)
871-874 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$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/2/00/97/2009794.cif $
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4,321,771 | 7.6015 | 0.0008 | 20.12 | 0.008 | 19.07 | 0.006 | 90 | null | 90 | null | 90 | null | 2,916.6 | 1.5 | 213 | 2 | 213 | 2 | null | null | null | null | synthesized | 5 | P b c n | -P 2n 2ab | 60 | Bis(dichloro-bis(diethylphosphine))-di-molybdenum (II), 1,3,6,8-isomer | - C16 H44 Cl4 Mo2 P4 - | - C16 H44 Cl4 Mo2 P4 - | - C64 H176 Cl16 Mo8 P16 - | 4 | 0.5 | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero | Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4 | Inorganic Chemistry | 1,999 | 38 | 490 | 495 | 10.1021/ic980972w | 0.71073 | MoKα | 0.0407 | 0.0345 | null | 0.0827 | 0.0783 | null | null | null | 1.094 | 1.111 | 1.111 | null | null | null | has coordinates,has disorder | F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero
Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4
Inorganic Chemistry
38
(1999)
490-495 | 179,320 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:16:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179320 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/17/4321771.cif $
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2,009,795 | 8.979 | 0.006 | 8.979 | 0.006 | 7.053 | 0.005 | 90 | null | 90 | null | 120 | null | 492.4 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -3 m 1 | -P 3 2" | 164 | Lithium bis(tetramethylammonium) hexanitrocobaltate(III) | - C8 H24 Co Li N8 O12 - | - C8 H24 Co Li N8 O12 - | - C8 H24 Co Li N8 O12 - | 1 | 0.083333 | MU1078 | Adovasio, Victor; Lina, Fausto; Nardelli, Mario; Pelizzi, Giancarlo | Lithium bis(tetramethyllammonium) hexanitrocobaltate(III) at 113 and 293 K | Acta Crystallographica Section C | 1,994 | 50 | 6 | 871 | 874 | 10.1107/S0108270193011588 | 0.71069 | MoKαmean | null | 0.021 | null | null | 0.0609 | null | null | null | null | null | null | null | null | null | has coordinates | Adovasio, Victor; Lina, Fausto; Nardelli, Mario; Pelizzi, Giancarlo
Lithium bis(tetramethyllammonium) hexanitrocobaltate(III) at 113 and 293 K
Acta Crystallographica Section C
50(6)
(1994)
871-874 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$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/2/00/97/2009795.cif $
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2,009,796 | 6.706 | 0.001 | 7.159 | 0.001 | 7.216 | 0.001 | 100.64 | 0.01 | 105.4 | 0.01 | 62.66 | 0.01 | 295.89 | 0.08 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C4 H12 B10 O4 - | - C4 H12 B10 O4 - | - C4 H12 B10 O4 - | 1 | 0.5 | NA1058 | Centore, R.; Ciajolo, M.R.; Tuzi, A.; Komarova, L.G.; Rusanov, A.L.; Vasnev, V.A. | Crystal and molecular structure of 1,12-dicarboxy-1,12-dicarba-<i>closo</i>-dodecaborane(12), C~4~H~12~B~10~O~4~ | Acta Crystallographica Section C | 1,994 | 50 | 6 | 905 | 907 | 10.1107/S0108270193011783 | 1.5418 | CuKα | null | 0.046 | null | null | 0.06 | null | null | null | null | 2.856 | 2.856 | null | null | null | has coordinates,has disorder | Centore, R.; Ciajolo, M.R.; Tuzi, A.; Komarova, L.G.; Rusanov, A.L.; Vasnev, V.A.
Crystal and molecular structure of 1,12-dicarboxy-1,12-dicarba-<i>closo</i>-dodecaborane(12), C~4~H~12~B~10~O~4~
Acta Crystallographica Section C
50(6)
(1994)
905-907 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$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/2/00/97/2009796.cif $
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2,009,797 | 7.815 | 0.001 | 10.019 | 0.001 | 9.338 | 0.001 | 90 | null | 93.58 | 0.01 | 90 | null | 729.72 | 0.14 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | hydrazinium(1+) hexafluorotitanate(IV) | - F6 H10 N4 Ti - | - F6 H10 N4 Ti - | - F24 H40 N16 Ti4 - | 4 | 2 | NA1062 | Leban, Ivan; Jesih, Adolf; Rahten, Anka | Hydrazinium(1+) hexafluorotitanate(IV), 2N~2~H~5~^+^.TiF~6~^2{-^} | Acta Crystallographica Section C | 1,994 | 50 | 6 | 842 | 843 | 10.1107/S0108270193011795 | 0.7107 | MoKα | 0.0653 | 0.0355 | null | 0.104 | 0.0923 | null | null | null | 1.04 | 1.069 | 1.069 | null | null | null | has coordinates | Leban, Ivan; Jesih, Adolf; Rahten, Anka
Hydrazinium(1+) hexafluorotitanate(IV), 2N~2~H~5~^+^.TiF~6~^2{-^}
Acta Crystallographica Section C
50(6)
(1994)
842-843 | 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/2/00/97/2009797.cif $
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2,009,798 | 7.769 | 0.001 | 6.575 | 0.001 | 15.258 | 0.003 | 90 | null | 95.49 | 0.04 | 90 | null | 775.8 | 0.2 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 1-methyl-2-methylthio-5-nitroimidazole | - C5 H7 N3 O2 S - | - C5 H7 N3 O2 S - | - C20 H28 N12 O8 S4 - | 4 | 1 | NA1068 | Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J. | 1-Methyl-2-methylthio-5-nitroimidazole, C~5~H~7~N~3~O~2~S | Acta Crystallographica Section C | 1,994 | 50 | 6 | 919 | 921 | 10.1107/S0108270193012521 | 0.71069 | MoKα | null | 0.038 | null | null | 0.062 | null | null | null | null | 0.9616 | 0.9616 | null | null | null | has coordinates | Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.
1-Methyl-2-methylthio-5-nitroimidazole, C~5~H~7~N~3~O~2~S
Acta Crystallographica Section C
50(6)
(1994)
919-921 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$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/2/00/97/2009798.cif $
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2,009,799 | 7.088 | 0.001 | 7.116 | 0.001 | 24.935 | 0.003 | 90 | null | 95.03 | 0.01 | 90 | null | 1,252.8 | 0.3 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 2-(5-nitro-2-styryl-1-imidazolyl)ethanol | - C13 H13 N3 O3 - | - C13 H13 N3 O3 - | - C52 H52 N12 O12 - | 4 | 1 | NA1069 | Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J. | 2-(5-Nitro-2-styryl-1-imidazolyl)ethanol | Acta Crystallographica Section C | 1,994 | 50 | 6 | 921 | 922 | 10.1107/S0108270193012533 | 0.71069 | MoKα | null | 0.0361 | null | null | 0.0577 | null | null | null | null | 0.9702 | 0.9702 | null | null | null | has coordinates | Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.
2-(5-Nitro-2-styryl-1-imidazolyl)ethanol
Acta Crystallographica Section C
50(6)
(1994)
921-922 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,770 | 5.975 | 0.003 | 14.517 | 0.002 | 10.617 | 0.003 | 90 | null | 92.74 | 0.03 | 90 | null | 919.9 | 0.5 | 296.2 | null | 296.2 | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | 14 | - C8 H7 Cl O Te - | - C8 H7 Cl O Te - | - C32 H28 Cl4 O4 Te4 - | 4 | 1 | Shinzi Kato; Osamu Niyomura; Shohou Nakaiida; Yasuyuki Kawahara; Takahiro Kanda; Ryo Yamada; Shinya Hori | First Isolation and Characterization of Sodium and Potassium Tellurocarboxylates: Structural Analysis of Te-Alkyl Telluroester | Inorganic Chemistry | 1,999 | 38 | 519 | 530 | 10.1021/ic980815x | 0.7107 | MoKα | null | 0.0326 | null | null | 0.0459 | null | null | null | null | 1.705 | 1.705 | null | null | null | has coordinates | Shinzi Kato; Osamu Niyomura; Shohou Nakaiida; Yasuyuki Kawahara; Takahiro Kanda; Ryo Yamada; Shinya Hori
First Isolation and Characterization of Sodium and Potassium Tellurocarboxylates: Structural Analysis of Te-Alkyl Telluroester
Inorganic Chemistry
38
(1999)
519-530 | 301,838 | 2025-08-20 | 22:17:34 | #------------------------------------------------------------------------------
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2,009,800 | 18.672 | 0.001 | 18.672 | 0.001 | 40.104 | 0.007 | 90 | null | 90 | null | 90 | null | 13,982 | 3 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | I 41/a :2 | -I 4ad | 88 | hexacarbonyl-1κ^4^C,2κ^2^C-η^5^-cyclopentadienyl-2κC-bis-μ- diphenylphosphanido-1κ^2^P:2κ^2^P-manganesetungsten | - C35 H25 Mn O6 P2 W - | - C35 H25 Mn O6 P2 W - | - C560 H400 Mn16 O96 P32 W16 - | 16 | 1 | NA1073 | Flörke, Ulrich; Haupt, Hans-Jürgen | Hexacarbonylcyclopentadienyl-bis-μ-diphenylphosphanido-manganesetungsten, [MnW(C~12~H~10~P)~2~(C~5~H~5~)(CO)~6~] | Acta Crystallographica Section C | 1,994 | 50 | 6 | 874 | 876 | 10.1107/S0108270193013526 | 0.71073 | MoKα | 0.1759 | 0.0684 | null | 0.1939 | 0.1447 | null | null | null | 1.066 | 1.176 | 1.176 | null | null | null | has coordinates | Flörke, Ulrich; Haupt, Hans-Jürgen
Hexacarbonylcyclopentadienyl-bis-μ-diphenylphosphanido-manganesetungsten, [MnW(C~12~H~10~P)~2~(C~5~H~5~)(CO)~6~]
Acta Crystallographica Section C
50(6)
(1994)
874-876 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,801 | 9.943 | 0.001 | 8.402 | 0.001 | 10.22 | 0.001 | 90 | null | 101.18 | 0.01 | 90 | null | 837.59 | 0.16 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | Structure of 5-nitro-2-furaldehyde-semicarbazone | - C6 H6 N4 O4 - | - C6 H6 N4 O4 - | - C24 H24 N16 O16 - | 4 | 1 | NA1082 | Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J. | 5-Nitro-2-furaldehyde semicarbazone | Acta Crystallographica Section C | 1,994 | 50 | 6 | 948 | 950 | 10.1107/S0108270194000119 | 0.71069 | MoKα | null | 0.0428 | null | null | 0.0765 | null | null | null | null | 0.939 | 0.939 | null | null | null | has coordinates | Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.
5-Nitro-2-furaldehyde semicarbazone
Acta Crystallographica Section C
50(6)
(1994)
948-950 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,802 | 9.8372 | 0.001 | 9.055 | 0.0005 | 5.3488 | 0.0006 | 90 | null | 107.175 | 0.005 | 90 | null | 455.2 | 0.07 | 298 | null | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | null | - Na O6 Sc Si2 - | - Na O6 Sc Si2 - | - Na4 O24 Sc4 Si8 - | 4 | 0.5 | OH1046 | Ohashi, H.; Osawa, T.; Sato, A. | NaScSi~2~O~6~ | Acta Crystallographica Section C | 1,994 | 50 | 6 | 838 | 840 | 10.1107/S010827019300962X | 0.71073 | MoKα | null | 0.018 | null | null | 0.034 | null | null | null | null | 1.3 | 1.3 | null | null | null | has coordinates | Ohashi, H.; Osawa, T.; Sato, A.
NaScSi~2~O~6~
Acta Crystallographica Section C
50(6)
(1994)
838-840 | 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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2,009,803 | 31.396 | 0.002 | 5.207 | 0.001 | 4.98 | 0.002 | 90 | null | 91.71 | 0.02 | 90 | null | 813.8 | 0.4 | 296 | 1 | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | - C16 H34 O2 - | - C16 H34 O2 - | - C32 H68 O4 - | 2 | 0.5 | OH1052 | Nakamura, N.; Yamamoto, T. | 1,16-Hexadecanediol, C~16~H~34~O~2~ | Acta Crystallographica Section C | 1,994 | 50 | 6 | 946 | 948 | 10.1107/S0108270193011849 | 1.5418 | CuKα | null | 0.049 | null | null | 0.079 | null | null | null | null | 1.74 | 1.74 | null | null | null | has coordinates | Nakamura, N.; Yamamoto, T.
1,16-Hexadecanediol, C~16~H~34~O~2~
Acta Crystallographica Section C
50(6)
(1994)
946-948 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,804 | 18.883 | 0.005 | 6.1671 | 0.0008 | 13.087 | 0.002 | 90 | null | 90 | null | 90 | null | 1,524 | 0.5 | 293 | null | null | null | null | null | null | null | 3 | P n a 21 | P 2c -2n | null | - C17 H18 N4 - | - C17 H18 N4 - | - C68 H72 N16 - | 4 | 1 | PA1067 | Rodier, N.; Robert-Piessard, S.; Robert, J.-M.; Baut, G. Le. | 4-(4,6-Diméthylpyrid-2-yl)-5-éthyl-3-phényl-4<i>H</i>-1,2,4-triazole | Acta Crystallographica Section C | 1,994 | 50 | 6 | 955 | 957 | 10.1107/S0108270193010339 | 1.5418 | CuKα | null | 0.054 | null | null | 0.052 | null | null | null | null | 1.87 | 1.87 | null | null | null | has coordinates | Rodier, N.; Robert-Piessard, S.; Robert, J.-M.; Baut, G. Le.
4-(4,6-Diméthylpyrid-2-yl)-5-éthyl-3-phényl-4<i>H</i>-1,2,4-triazole
Acta Crystallographica Section C
50(6)
(1994)
955-957 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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