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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,001,642 | 21.778 | 0.003 | 16.707 | 0.002 | 12.367 | 0.002 | 90 | null | 97.89 | 0.03 | 90 | null | 4,457.1 | 1.1 | 298 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C30 H22 N2 O3 - | - C30 H22 N2 O3 - | - C240 H176 N16 O24 - | 8 | 2 | NA1026 | Millini, R.; Del Piero, G.; Allegrini, P.; Malatesta, V.; Castaldi, G. | Structure of photochromic spiroxazines. II. 1',3',3'-Trimethylspiro{anthra[2,1-<i>f</i>][1,4]benzoxazine-2,2'-indoline}-7,12-dione | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1205 | 1207 | 10.1107/S010827019300006X | 1.54178 | CuKα | null | 0.049 | null | null | 0.043 | null | null | null | null | 1.67 | 1.67 | null | null | null | has coordinates | Millini, R.; Del Piero, G.; Allegrini, P.; Malatesta, V.; Castaldi, G.
Structure of photochromic spiroxazines. II. 1',3',3'-Trimethylspiro{anthra[2,1-<i>f</i>][1,4]benzoxazine-2,2'-indoline}-7,12-dione
Acta Crystallographica Section C
49(6)
(1993)
1205-1207 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,643 | 9.045 | 0.003 | 9.67 | 0.003 | 14.807 | 0.004 | 90 | null | 90 | null | 90 | null | 1,295.1 | 0.7 | 153 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C15 H18 O4 - | - C15 H18 O4 - | - C60 H72 O16 - | 4 | 1 | VS1002 | Huipe-Nava, E.; Igonin, V. A.; Lindeman, S. V.; Struchkov, Yu. T.; Mendoza, V.; Garcia G., E.; Guzman, J. A. | β-Homopipitzolone | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1207 | 1209 | 10.1107/S0108270192013374 | 0.71073 | MoKα | null | 0.033 | null | null | 0.032 | null | null | null | null | 0.52 | 0.52 | null | null | null | has coordinates | Huipe-Nava, E.; Igonin, V. A.; Lindeman, S. V.; Struchkov, Yu. T.; Mendoza, V.; Garcia G., E.; Guzman, J. A.
β-Homopipitzolone
Acta Crystallographica Section C
49(6)
(1993)
1207-1209 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,644 | 7.333 | 0.001 | 8.339 | 0.001 | 15.616 | 0.004 | 95.68 | 0.01 | 103.2 | 0.02 | 107.62 | 0.02 | 871.4 | 0.3 | 289 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C16 H12 F3 N3 O6 - | - C16 H12 F3 N3 O6 - | - C32 H24 F6 N6 O12 - | 2 | 1 | LI1038 | Brown, D. M.; Lin, P. K. T.; Van Meervelt, L. | Structure of 4-nitrobenzyl <i>N</i>-(4-nitrobenzyloxy)trifluoroacetimidate | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1209 | 1211 | 10.1107/S0108270192013271 | 1.54184 | CuKα | null | 0.0709 | null | null | 0.0637 | null | null | null | null | 1.02 | 1.02 | null | null | null | has coordinates | Brown, D. M.; Lin, P. K. T.; Van Meervelt, L.
Structure of 4-nitrobenzyl <i>N</i>-(4-nitrobenzyloxy)trifluoroacetimidate
Acta Crystallographica Section C
49(6)
(1993)
1209-1211 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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4,063,481 | 23.555 | 0.015 | 7.215 | 0.005 | 19.145 | 0.013 | 90 | null | 119.881 | 0.011 | 90 | null | 2,821 | 3 | 150 | 2 | 150 | 2 | null | null | null | null | 2 | C 1 2/c 1 | -C 2yc | 15 | - C20 H14 - | - C20 H14 - | - C160 H112 - | 8 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.0747 | 0.0506 | null | null | 0.1579 | 0.1766 | null | null | null | null | null | 1.021 | null | null | has coordinates,has disorder | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 301,829 | 2025-08-20 | 12:17:35 | #------------------------------------------------------------------------------
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2,001,645 | 14.597 | 0.005 | 13.153 | 0.005 | 6.584 | 0.003 | 90 | null | 90 | null | 90 | null | 1,264.1 | 0.9 | 298 | null | null | null | null | null | null | null | 4 | I b a m | -I 2 2c | null | - C5 H4 N4 S - | - C5 H4 N4 S - | - C40 H32 N32 S8 - | 8 | 0.5 | CR1037 | Singh, P.; Pedersen, L. G. | Orthorhombic form of thiopurinol: 1,5-dihydro-4<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine-4-thione | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1211 | 1215 | 10.1107/S0108270192013453 | 0.71073 | MoKα | null | 0.043 | null | null | 0.06 | null | null | null | null | 1.4 | 1.4 | null | null | null | has coordinates | Singh, P.; Pedersen, L. G.
Orthorhombic form of thiopurinol: 1,5-dihydro-4<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine-4-thione
Acta Crystallographica Section C
49(6)
(1993)
1211-1215 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,646 | 12.137 | 0.002 | 12.181 | 0.002 | 11.694 | 0.002 | 100.39 | 0.01 | 100.1 | 0.01 | 78.02 | 0.01 | 1,646.3 | 0.5 | 298 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C6 Cl3 N3 O6 - | - C6 Cl3 N3 O6 - | - C36 Cl18 N18 O36 - | 6 | 3 | DU1015 | Gerard, F.; Hardy, A.; Becuwe, A. | Structure of 1,3,5-trichloro-2,4,6-trinitrobenzene | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1215 | 1218 | 10.1107/S0108270193000034 | 0.7093 | MoKα | null | 0.029 | null | null | 0.034 | null | null | null | null | 1.33 | 1.33 | null | null | null | has coordinates | Gerard, F.; Hardy, A.; Becuwe, A.
Structure of 1,3,5-trichloro-2,4,6-trinitrobenzene
Acta Crystallographica Section C
49(6)
(1993)
1215-1218 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,001,647 | 10.897 | 0.001 | 6.941 | 0.001 | 6.345 | 0.001 | 64.28 | 0.01 | 74.32 | 0.01 | 74.81 | 0.01 | 410.44 | 0.1 | 293 | null | 293 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | cis-4-Cyclohexene-1,2-dicarboxylic Acid | - C8 H10 O4 - | - C8 H10 O4 - | - C16 H20 O8 - | 2 | 1 | SH1025 | Küppers, H.; Kim, S. A. | Structure of <i>cis</i>-4-cyclohexene-1,2-dicarboxylic acid | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1218 | 1220 | 10.1107/S0108270193000095 | 0.7107 | MolybdenumKα | null | 0.066 | null | null | 0.049 | null | null | null | null | null | null | null | null | null | has coordinates | Küppers, H.; Kim, S. A.
Structure of <i>cis</i>-4-cyclohexene-1,2-dicarboxylic acid
Acta Crystallographica Section C
49(6)
(1993)
1218-1220 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,648 | 21.953 | 0.005 | 8.961 | 0.003 | 13.588 | 0.003 | 90 | null | 96.07 | 0.03 | 90 | null | 2,658.1 | 1.2 | 295 | 0.5 | 295 | 0.5 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | 1,10-Dimethyl-4,7,13,16,21,24-hexaoxa-1,10-diazoniabicyclo[8.8.8]hexacosane diiodide | - C20 H42 I2 N2 O6 - | - C20 H42 I2 N2 O6 - | - C80 H168 I8 N8 O24 - | 4 | 0.5 | SH1028 | Korber, N.; Jansen, M. | <i>N</i>,<i>N</i>'-Dimethylcryptand[2.2.2] diiodide | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1220 | 1222 | 10.1107/S0108270192012824 | 0.71069 | MoKα | 0.032 | 0.0298 | null | 0.0789 | 0.0772 | null | null | null | 1.144 | 1.165 | 1.165 | null | null | null | has coordinates | Korber, N.; Jansen, M.
<i>N</i>,<i>N</i>'-Dimethylcryptand[2.2.2] diiodide
Acta Crystallographica Section C
49(6)
(1993)
1220-1222 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,649 | 7.578 | 0.002 | 8.735 | 0.002 | 9.371 | 0.002 | 90 | null | 90 | null | 90 | null | 620.3 | 0.3 | 296 | 1 | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C4 H5 Br O4 - | - C4 H5 Br O4 - | - C16 H20 Br4 O16 - | 4 | 1 | BR1027 | Britten, J. F.; Howard-Lock, H. E.; Leblanc, D.; Lock, C. J. L. | (<i>R</i>)-2-Bromo-1,4-butanedioic acid | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1222 | 1224 | 10.1107/S0108270192013210 | 1.54178 | CuKα | null | 0.0424 | null | null | 0.0419 | null | null | null | null | 1.97 | 1.97 | null | null | null | has coordinates | Britten, J. F.; Howard-Lock, H. E.; Leblanc, D.; Lock, C. J. L.
(<i>R</i>)-2-Bromo-1,4-butanedioic acid
Acta Crystallographica Section C
49(6)
(1993)
1222-1224 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,650 | 10.808 | 0.002 | 10.808 | 0.002 | 10.883 | 0.001 | 90 | null | 90 | null | 120 | 0.1 | 1,101 | 1.2 | 295 | null | null | null | null | null | null | null | 3 | P 31 | P 31 | null | - C20 H14 O2 - | - C20 H14 O2 - | - C60 H42 O6 - | 3 | 1 | OH1012 | Mori, K.; Masuda, Y.; Kashino, S. | (+)-(<i>R</i>)- and racemic forms of 2,2'-dihydroxy-1,1'-binaphthyl | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1224 | 1227 | 10.1107/S0108270193000083 | 1.54178 | CuKα | null | 0.03 | null | null | 0.039 | null | null | null | null | 1.357 | 1.357 | null | null | null | has coordinates | Mori, K.; Masuda, Y.; Kashino, S.
(+)-(<i>R</i>)- and racemic forms of 2,2'-dihydroxy-1,1'-binaphthyl
Acta Crystallographica Section C
49(6)
(1993)
1224-1227 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,651 | 15.696 | 0.002 | 21.617 | 0.002 | 8.6253 | 0.0006 | 90 | null | 90 | null | 90 | null | 2,926.6 | 0.5 | 295 | null | null | null | null | null | null | null | 3 | I b a 2 | I 2 -2c | null | - C20 H14 O2 - | - C20 H14 O2 - | - C160 H112 O16 - | 8 | 1 | OH1012 | Mori, K.; Masuda, Y.; Kashino, S. | (+)-(<i>R</i>)- and racemic forms of 2,2'-dihydroxy-1,1'-binaphthyl | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1224 | 1227 | 10.1107/S0108270193000083 | 1.54178 | CuKα | null | 0.034 | null | null | 0.039 | null | null | null | null | 1.214 | 1.214 | null | null | null | has coordinates | Mori, K.; Masuda, Y.; Kashino, S.
(+)-(<i>R</i>)- and racemic forms of 2,2'-dihydroxy-1,1'-binaphthyl
Acta Crystallographica Section C
49(6)
(1993)
1224-1227 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,652 | 19.979 | 0.002 | 24.115 | 0.003 | 8.998 | 0.0014 | 90 | null | 90 | null | 90 | null | 4,335.2 | 1 | 296 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C39 H73 N O14 - | - C39 H73 N O14 - | - C156 H292 N4 O56 - | 4 | 1 | OH1013 | Iwasaki, H.; Sugawara, Y.; Adachi, T.; Morimoto, S.; Watanabe, Y. | Structure of 6-<i>O</i>-methylerythromycin A (clarithromycin) | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1227 | 1230 | 10.1107/S0108270193000186 | 0.71073 | MoKα | null | 0.045 | null | null | 0.053 | null | null | null | null | 0.7823 | 0.7823 | null | null | null | has coordinates | Iwasaki, H.; Sugawara, Y.; Adachi, T.; Morimoto, S.; Watanabe, Y.
Structure of 6-<i>O</i>-methylerythromycin A (clarithromycin)
Acta Crystallographica Section C
49(6)
(1993)
1227-1230 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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4,063,480 | 7.5602 | 0.0009 | 33.767 | 0.004 | 12.2325 | 0.0015 | 90 | null | 95.88 | 0.003 | 90 | null | 3,106.3 | 0.6 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C34 H32 Cl2 N4 Pd - | - C34 H32 Cl2 N4 Pd - | - C136 H128 Cl8 N16 Pd4 - | 4 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.086 | 0.0627 | null | null | 0.1724 | 0.1876 | null | null | null | null | null | 1.208 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,653 | 8.311 | 0.003 | 10.552 | 0.003 | 7.508 | 0.005 | 97.45 | 0.04 | 115.59 | 0.03 | 104.36 | 0.02 | 553.8 | 0.5 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C14 H11 N O3 - | - C14 H11 N O3 - | - C28 H22 N2 O6 - | 2 | 1 | AL1004 | Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N. | Structure of a pyrano[2,3-<i>b</i>]indolizine | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1230 | 1232 | 10.1107/S0108270192012769 | 0.71069 | MoKα | null | 0.044 | null | null | 0.055 | null | null | null | null | 1.84 | 1.84 | null | null | null | has coordinates | Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N.
Structure of a pyrano[2,3-<i>b</i>]indolizine
Acta Crystallographica Section C
49(6)
(1993)
1230-1232 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,654 | 9.492 | 0.002 | 4.674 | 0.006 | 49.39 | 0.01 | 90 | null | 93.65 | 0.02 | 90 | null | 2,187 | 3 | 221 | null | null | null | null | null | null | null | 3 | P 1 21/a 1 | -P 2yab | null | - C22 H42 O2 - | - C22 H42 O2 - | - C88 H168 O8 - | 4 | 1 | OH1011 | Kaneko, F.; Yamazaki, K.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M. | Structure of the γ phase of erucic acid | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1232 | 1234 | 10.1107/S0108270193000071 | 1.5418 | CuKα | null | 0.051 | null | null | 0.067 | null | null | null | null | 1.52 | 1.52 | null | null | null | has coordinates | Kaneko, F.; Yamazaki, K.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.
Structure of the γ phase of erucic acid
Acta Crystallographica Section C
49(6)
(1993)
1232-1234 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,655 | 9.145 | 0.001 | 16.756 | 0.002 | 18.201 | 0.002 | 90 | null | 90 | null | 90 | null | 2,789 | 0.5 | 293 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C30 H36 O7 - | - C30 H36 O7 - | - C120 H144 O28 - | 4 | 1 | ST1038 | Abboud, K. A.; Jiang, S.; Enholm, E. J. | Structure of a coupled carbohydrate and terpene | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1234 | 1237 | 10.1107/S0108270193000113 | 0.71073 | MoKα | null | 0.0527 | null | null | 0.0503 | null | null | null | null | 1.6 | 1.6 | null | null | null | has coordinates | Abboud, K. A.; Jiang, S.; Enholm, E. J.
Structure of a coupled carbohydrate and terpene
Acta Crystallographica Section C
49(6)
(1993)
1234-1237 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,656 | 6.4176 | 0.0009 | 12.296 | 0.002 | 12.215 | 0.002 | 90 | null | 114.3 | 0.01 | 90 | null | 878.5 | 0.2 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Hydrogenophosphate of piperazinium monohydrated | Hydrogenophosphate of piperazinium monohydrated | - C4 H15 N2 O5 P - | - C4 H14 N2 O5 P - | - C16 H56 N8 O20 P4 - | 4 | 1 | DU1011 | Riou, D.; Loiseau, T.; Ferey, G. | Structure determination of a monohydrated piperazinium hydrogenphosphate | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1237 | 1238 | 10.1107/S0108270193000496 | 0.71069 | MoKα | null | 0.039 | null | null | 0.034 | null | null | null | null | null | null | null | null | null | has coordinates | Riou, D.; Loiseau, T.; Ferey, G.
Structure determination of a monohydrated piperazinium hydrogenphosphate
Acta Crystallographica Section C
49(6)
(1993)
1237-1238 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,657 | 5.95 | 0.002 | 8.238 | 0.001 | 9.952 | 0.002 | 90 | null | 102.82 | 0.02 | 90 | null | 475.6 | 0.2 | 296 | null | 296 | null | null | null | null | null | 4 | P 1 21 1 | null | (4S,5S)-4-Methyl-5-phenyl-2-oxazolidinone | - C10 H11 N O2 - | - C10 H11 N O2 - | - C20 H22 N2 O4 - | 2 | 1 | CR1047 | Robinson, P. D.; Hua, D. H.; Good, L. A.; Wang, H.; Meyers, C. Y. | (4<i>S</i>,5<i>S</i>)-4-Methyl-5-phenyl-1,3-oxazolidin-2-one | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1238 | 1240 | 10.1107/S0108270192013477 | 0.71069 | MoKα | null | 0.029 | null | null | 0.036 | null | null | null | null | 1.51 | 1.51 | null | null | null | has coordinates | Robinson, P. D.; Hua, D. H.; Good, L. A.; Wang, H.; Meyers, C. Y.
(4<i>S</i>,5<i>S</i>)-4-Methyl-5-phenyl-1,3-oxazolidin-2-one
Acta Crystallographica Section C
49(6)
(1993)
1238-1240 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,658 | 19.14 | 0.03 | 7.635 | 0.003 | 19.838 | 0.001 | 90 | null | 99.84 | 0.04 | 90 | null | 2,856 | 5 | 293 | null | null | null | null | null | null | null | 3 | I 1 2 1 | I 2y | null | - C29 H52 O7 - | - C29 H52 O6.5 - | - C116 H208 O26 - | 4 | 1 | HA1010 | Sivaraman, J.; Subramanian, K.; Velmurugan, D.; Subramanian, E.; Balakrishna, K. | Structure of vicogenin | Acta Crystallographica Section C | 1,993 | 49 | 6 | 1240 | 1242 | 10.1107/S0108270192013556 | 1.5418 | CuKα | null | 0.056 | null | null | 0.06 | null | null | null | null | 2.3 | 2.3 | null | null | null | has coordinates | Sivaraman, J.; Subramanian, K.; Velmurugan, D.; Subramanian, E.; Balakrishna, K.
Structure of vicogenin
Acta Crystallographica Section C
49(6)
(1993)
1240-1242 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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4,063,479 | 15.823 | 0.005 | 14.132 | 0.005 | 15.342 | 0.005 | 90 | null | 114.275 | 0.017 | 90 | null | 3,127.3 | 1.8 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | - C34 H32 Cl2 N4 Pd - | - C34 H32 Cl2 N4 Pd - | - C136 H128 Cl8 N16 Pd4 - | 4 | 0.5 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.0792 | 0.0373 | null | null | 0.0882 | 0.1145 | null | null | null | null | null | 0.977 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-21 06:41:29 +0200 (Mon, 21 Mar 2016) $
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2,001,659 | 6.608 | 0.001 | 6.899 | 0.001 | 12.977 | 0.002 | 82.66 | 0.01 | 80.64 | 0.01 | 73.97 | 0.01 | 558.88 | 0.15 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - Eu2 H8 O11.5 P3 - | - Eu2 H3 O12 P3 - | - Eu4 H6 O24 P6 - | 2 | 1 | DU1019 | Foulon, J.-D.; Tijani, N.; Durand, J.; Rafiq, M.; Cot, L. | Structure de Eu~2~(PO~3~H)~3~.2,5H~2~O | Acta Crystallographica Section C | 1,993 | 49 | 5 | 849 | 851 | 10.1107/S0108270192012587 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Foulon, J.-D.; Tijani, N.; Durand, J.; Rafiq, M.; Cot, L.
Structure de Eu~2~(PO~3~H)~3~.2,5H~2~O
Acta Crystallographica Section C
49(5)
(1993)
849-851 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,001,660 | 9.73439 | 0.00009 | 9.73439 | 0.00009 | 11.892 | 0.0002 | 90 | null | 90 | null | 120 | null | 975.89 | 0.02 | null | null | null | null | null | null | null | null | 3 | R -3 c | -R 3 2"c | null | - Ir O6 Sr4 - | - Ir O6 Sr4 - | - Ir6 O36 Sr24 - | 6 | null | HU1016 | Powell, A. V.; Battle, P. D.; Gore, J. G. | Structure of Sr~4~IrO~6~ by time-of-flight neutron powder diffraction | Acta Crystallographica Section C | 1,993 | 49 | 5 | 852 | 854 | 10.1107/S0108270192012721 | neutron | null | Neutron | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Powell, A. V.; Battle, P. D.; Gore, J. G.
Structure of Sr~4~IrO~6~ by time-of-flight neutron powder diffraction
Acta Crystallographica Section C
49(5)
(1993)
852-854 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,661 | 11.45 | 0.002 | 8.409 | 0.002 | 9.847 | 0.001 | 90 | null | 95.28 | 0.01 | 90 | null | 944.1 | 0.3 | null | null | null | null | null | null | null | null | 4 | P 1 21/m 1 | -P 2yb | 11 | - Cu2 O19 Rb2 Si8 - | - Cu2 O19 Rb2 Si8 - | - Cu4 O38 Rb4 Si16 - | 2 | 0.5 | OH1000 | Watanabe, I.; Kawahara, A. | Structure of a synthetic double-layer silicate, Rb~2~Cu~2~Si~8~O~19~ | Acta Crystallographica Section C | 1,993 | 49 | 5 | 854 | 856 | 10.1107/S0108270192011892 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Watanabe, I.; Kawahara, A.
Structure of a synthetic double-layer silicate, Rb~2~Cu~2~Si~8~O~19~
Acta Crystallographica Section C
49(5)
(1993)
854-856 | 205,956 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-01-31 13:05:05 +0200 (Wed, 31 Jan 2018) $
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2,001,662 | 13.126 | 0.002 | 16.274 | 0.007 | 11.756 | 0.004 | 96.77 | 0.02 | 90.04 | 0.02 | 77.77 | 0.02 | 2,436.4 | 1.4 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - H17 K10 O50 W12 - | - H2 K10 O52 W12 - | - H4 K20 O104 W24 - | 2 | 1 | GR0197 | Evans, Jnr, H. T.; Kortz, U.; Jameson, G. B. | Structure of potassium paradodecatungstate 71/2-hydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 856 | 861 | 10.1107/S0108270192012010 | 0.7107 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Evans, Jnr, H. T.; Kortz, U.; Jameson, G. B.
Structure of potassium paradodecatungstate 71/2-hydrate
Acta Crystallographica Section C
49(5)
(1993)
856-861 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,001,663 | 8.686 | 0.001 | 12.483 | 0.002 | 12.933 | 0.002 | 73.09 | 0.01 | 73.65 | 0.01 | 70.87 | 0.01 | 1,240.4 | 0.3 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C28 H42 Cl14 N10 Ni5 - | - C28 H46 Cl14 N10 Ni5 - | - C28 H46 Cl14 N10 Ni5 - | 1 | 0.5 | ST0571 | Bond, M. R.; Willett, R. D. | Structures of tetrakis(2-amino-6-methylpyridinium) <i>catena</i>-bis(acetonitrile)tetradeca-μ-chloro-pentanickelate(II) and bis(3-picolinium) <i>catena</i>-diaquaocta-μ-chloro-trinickelate(II) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 861 | 865 | 10.1107/S0108270192009600 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Bond, M. R.; Willett, R. D.
Structures of tetrakis(2-amino-6-methylpyridinium) <i>catena</i>-bis(acetonitrile)tetradeca-μ-chloro-pentanickelate(II) and bis(3-picolinium) <i>catena</i>-diaquaocta-μ-chloro-trinickelate(II)
Acta Crystallographica Section C
49(5)
(1993)
861-865 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,001,664 | 7.648 | 0.001 | 8.498 | 0.001 | 9.55 | 0.001 | 85.15 | 0.01 | 83.71 | 0.01 | 69.08 | 0.01 | 575.58 | 0.12 | null | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C12 H20 Cl8 N2 Ni3 O2 - | - C12 H20 Cl8 N2 Ni3 O2 - | - C12 H20 Cl8 N2 Ni3 O2 - | 1 | 0.5 | ST0571 | Bond, M. R.; Willett, R. D. | Structures of tetrakis(2-amino-6-methylpyridinium) <i>catena</i>-bis(acetonitrile)tetradeca-μ-chloro-pentanickelate(II) and bis(3-picolinium) <i>catena</i>-diaquaocta-μ-chloro-trinickelate(II) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 861 | 865 | 10.1107/S0108270192009600 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Bond, M. R.; Willett, R. D.
Structures of tetrakis(2-amino-6-methylpyridinium) <i>catena</i>-bis(acetonitrile)tetradeca-μ-chloro-pentanickelate(II) and bis(3-picolinium) <i>catena</i>-diaquaocta-μ-chloro-trinickelate(II)
Acta Crystallographica Section C
49(5)
(1993)
861-865 | 208,360 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,063,478 | 9.0547 | 0.0007 | 25.3595 | 0.0018 | 9.7807 | 0.0007 | 90 | null | 111.778 | 0.001 | 90 | null | 2,085.6 | 0.3 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C22 H21 Cl2 N3 Pd - | - C22 H21 Cl2 N3 Pd - | - C88 H84 Cl8 N12 Pd4 - | 4 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.0292 | 0.0219 | null | null | 0.0544 | 0.0572 | null | null | null | null | null | 1.125 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-21 06:41:29 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178529 $
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2,001,665 | 8.294 | 0.001 | 10.981 | 0.003 | 11.934 | 0.003 | 90 | null | 107.04 | 0.02 | 90 | null | 1,039.2 | 0.4 | null | null | null | null | null | null | null | null | 6 | P 1 21 1 | P 2yb | 4 | - C10 H28 Cl3 Er N2 O9 - | - C10 H18 Cl3 Er N2 O9 - | - C20 H36 Cl6 Er2 N4 O18 - | 2 | 1 | MU1025 | Ma, A.-Z.; Li, L.-M.; Lin, Y.-H.; Xi, S.-Q. | Structure of an erbium coordination compound with <small>L</small>-proline, {[Er(Pro)~2~(H~2~O)~5~]Cl~3~}~<i>n~</i> | Acta Crystallographica Section C | 1,993 | 49 | 5 | 865 | 867 | 10.1107/S0108270192012113 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Ma, A.-Z.; Li, L.-M.; Lin, Y.-H.; Xi, S.-Q.
Structure of an erbium coordination compound with <small>L</small>-proline, {[Er(Pro)~2~(H~2~O)~5~]Cl~3~}~<i>n~</i>
Acta Crystallographica Section C
49(5)
(1993)
865-867 | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,666 | 7.597 | 0.005 | 12.951 | 0.003 | 13.131 | 0.005 | 90 | null | 90 | null | 90 | null | 1,291.9 | 1 | null | null | null | null | null | null | null | null | 6 | P n a m | -P 2c -2n | null | - C6 H10 K2 N O11 V - | - C6 H10 K2 N O11 V - | - C24 H40 K8 N4 O44 V4 - | 4 | 0.5 | AB1026 | Lapshin, A. E.; Smolin, Y. I.; Shepelev, Y. F.; Sivák, M.; Gyepesová, D. | Structure of dipotassium (nitrilo-κ<i>N</i>-triacetato-κ^3^<i></i><i>O</i>,<i>O</i>'',<i>O</i>'''')oxoperoxovanadate(V)‒water (1/2) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 867 | 870 | 10.1107/S0108270192011843 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Lapshin, A. E.; Smolin, Y. I.; Shepelev, Y. F.; Sivák, M.; Gyepesová, D.
Structure of dipotassium (nitrilo-κ<i>N</i>-triacetato-κ^3^<i></i><i>O</i>,<i>O</i>'',<i>O</i>'''')oxoperoxovanadate(V)‒water (1/2)
Acta Crystallographica Section C
49(5)
(1993)
867-870 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,001,667 | 13.46 | 0.005 | 9.632 | 0.003 | 24.667 | 0.002 | 90 | null | 107.79 | 0.06 | 90 | null | 3,045.1 | 1.8 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C38 H28 N6 O4 Zn - | - C38 H28 N6 O4 Zn - | - C152 H112 N24 O16 Zn4 - | 4 | 1 | MU0262 | Sur, H.; Roychowdhuri, S.; Seth, S. | Structure of bis{2'-[α-(2-pyridyl)benzylidene]salicylohydrazido}zinc(II) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 870 | 873 | 10.1107/S0108270192012319 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Sur, H.; Roychowdhuri, S.; Seth, S.
Structure of bis{2'-[α-(2-pyridyl)benzylidene]salicylohydrazido}zinc(II)
Acta Crystallographica Section C
49(5)
(1993)
870-873 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,668 | 17.152 | 0.014 | 7.146 | 0.005 | 21 | 0.03 | 90 | null | 93 | 0.09 | 90 | null | 2,570 | 5 | null | null | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | null | - C18 H34 N2 O2 S4 Sn - | - C18 H34 N2 O2 S4 Sn - | - C72 H136 N8 O8 S16 Sn4 - | 4 | 0.5 | DU1017 | Vrábel, V.; Kellö, E. | Structure of di(<i>n</i>-butyl)bis(morpholinocarbodithioato-κ^2^<i>S,S'</i>)tin(IV) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 873 | 875 | 10.1107/S0108270192013040 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Vrábel, V.; Kellö, E.
Structure of di(<i>n</i>-butyl)bis(morpholinocarbodithioato-κ^2^<i>S,S'</i>)tin(IV)
Acta Crystallographica Section C
49(5)
(1993)
873-875 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,001,669 | 8.999 | 0.001 | 23.055 | 0.001 | 9.382 | 0.001 | 90 | null | 108.58 | 0.01 | 90 | null | 1,845 | 0.3 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C13 H26 N4 O9 Pb - | - C13 H26 N4 O9 Pb - | - C52 H104 N16 O36 Pb4 - | 4 | 1 | CR1028 | Inoue, M. B.; Fernando, Q.; Villegas, C. A.; Inoue, M. | Structure of a lead(II) complex of a new 13-membered macrocycle with two pendant carboxymethyl groups | Acta Crystallographica, Section C: Crystal Structure Communications | 1,993 | 49 | 5 | 875 | 878 | 10.1107/s0108270192013593 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Inoue, M. B.; Fernando, Q.; Villegas, C. A.; Inoue, M.
Structure of a lead(II) complex of a new 13-membered macrocycle with two pendant carboxymethyl groups
Acta Crystallographica, Section C: Crystal Structure Communications
49(5)
(1993)
875-878 | 180,654 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,063,477 | 19.941 | 0.012 | 10.116 | 0.006 | 22.057 | 0.013 | 90 | null | 93.222 | 0.011 | 90 | null | 4,442 | 5 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C22 H23 Cl2 N3 Pd - | - C22 H23 Cl2 N3 Pd - | - C176 H184 Cl16 N24 Pd8 - | 8 | 2 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.0892 | 0.0454 | null | null | 0.1122 | 0.1348 | null | null | null | null | null | 1.003 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-21 06:41:29 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178529 $
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2,001,670 | 12.217 | 0.002 | 16.848 | 0.006 | 18.834 | 0.003 | 90 | null | 100.37 | 0.02 | 90 | null | 3,813.3 | 1.6 | null | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C39 H63 B F15 O2 Ta - | - C39 H35 B F15 O2 Ta - | - C156 H140 B4 F60 O8 Ta4 - | 4 | 1 | HH0591 | Schaefer, W. P.; Quan, R. W.; Bercaw, J. E. | Structure of hydroxo(methyl)bis(η^5^-pentamethylcyclopentadienyl)tantalum(V) hydroxotris(pentafluorophenyl)borate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 878 | 881 | 10.1107/S0108270192003998 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates,has disorder | Schaefer, W. P.; Quan, R. W.; Bercaw, J. E.
Structure of hydroxo(methyl)bis(η^5^-pentamethylcyclopentadienyl)tantalum(V) hydroxotris(pentafluorophenyl)borate
Acta Crystallographica Section C
49(5)
(1993)
878-881 | 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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2,001,671 | 7.473 | 0.001 | 7.779 | 0.002 | 9.787 | 0.002 | 109.46 | 0.03 | 98.56 | 0.03 | 98.29 | 0.03 | 518.9 | 0.2 | null | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C12 H20 N8 O8 P2 Pt - | - C12 H12 N8 O10 P2 Pt - | - C12 H12 N8 O10 P2 Pt - | 1 | 0.5 | BR1016 | Britten, J. F.; Lock, C. J. L.; Wang, Z. | Bis[di(imidazol-2-yl)phosphinato-<i>N</i>^3^,<i>N</i>^3'^]platinum(II) tetrahydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 881 | 884 | 10.1107/S0108270192013258 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Britten, J. F.; Lock, C. J. L.; Wang, Z.
Bis[di(imidazol-2-yl)phosphinato-<i>N</i>^3^,<i>N</i>^3'^]platinum(II) tetrahydrate
Acta Crystallographica Section C
49(5)
(1993)
881-884 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,001,672 | 12.079 | 0.002 | 12.671 | 0.003 | 18.01 | 0.02 | 101.46 | 0.05 | 96.45 | 0.06 | 113.6 | 0.03 | 2,418 | 3 | null | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C38 H46 Br4 N2 O13 Pb - | - C38 H46 Br4 N2 O13 Pb - | - C76 H92 Br8 N4 O26 Pb2 - | 2 | 1 | HU0410 | García-Granda, S.; Díaz, M. R.; Gómez-Beltrán, F.; Blanco-Gomís, D. | Structure of (4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)lead(II) eosin dihydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 884 | 886 | 10.1107/S010827019200979X | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | García-Granda, S.; Díaz, M. R.; Gómez-Beltrán, F.; Blanco-Gomís, D.
Structure of (4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)lead(II) eosin dihydrate
Acta Crystallographica Section C
49(5)
(1993)
884-886 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,001,673 | 11.749 | 0.003 | 8.3 | 0.002 | 14.725 | 0.002 | 90 | null | 103.97 | 0.02 | 90 | null | 1,393.5 | 0.5 | null | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C8 H19 Cl O5 Sn - | - C8 H Cl O5 Sn - | - C32 H4 Cl4 O20 Sn4 - | 4 | 1 | BR1020 | Lambert, J. B.; Kuhlmann, B.; Stern, C. L. | Structure of the dimer of dibutylhydroxystannyl perchlorate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 887 | 890 | 10.1107/S0108270192011648 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Lambert, J. B.; Kuhlmann, B.; Stern, C. L.
Structure of the dimer of dibutylhydroxystannyl perchlorate
Acta Crystallographica Section C
49(5)
(1993)
887-890 | 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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2,001,674 | 11.864 | 0.003 | 7.726 | 0.002 | 14.832 | 0.003 | 90 | null | 102.17 | 0.02 | 90 | null | 1,329 | 0.6 | null | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C27 H26 Cu N4 O6 - | - C27 H26 Cu N4 O6 - | - C54 H52 Cu2 N8 O12 - | 2 | 1 | MU0252 | Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R. | Mixed chelate complexes. II. Structures of <small>L</small>-alaninato(aqua)(4,7-diphenyl-1,10-phenanthroline)copper(II) nitrite monohydrate and aqua(4,7-dimethyl-1,10-phenanthroline)(glycinato)(nitrato)copper(II) monohydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 890 | 893 | 10.1107/S0108270192000556 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R.
Mixed chelate complexes. II. Structures of <small>L</small>-alaninato(aqua)(4,7-diphenyl-1,10-phenanthroline)copper(II) nitrite monohydrate and aqua(4,7-dimethyl-1,10-phenanthroline)(glycinato)(nitrato)copper(II) monohydrate
Acta Crystallographi... | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-01-30 16:30:45 +0200 (Tue, 30 Jan 2018) $
#$Revision: 205898 $
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4,063,476 | 16.8134 | 0.0004 | 16.3899 | 0.0004 | 27.0373 | 0.0007 | 90 | null | 103.143 | 0.002 | 90 | null | 7,255.5 | 0.3 | 100 | 2 | 100 | 2 | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | - C74 H106 Cl4 N4 O P2 Pd2 - | - C74 H106 Cl4 N4 O P2 Pd2 - | - C296 H424 Cl16 N16 O4 P8 Pd8 - | 4 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | 0.71073 | MoKα | 0.1192 | 0.0591 | null | null | 0.1477 | 0.1566 | null | null | null | null | null | 1.111 | null | null | has coordinates,has disorder | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-21 06:41:29 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178529 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/06/34/4063476.cif $
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2,001,675 | 14.138 | 0.003 | 10.016 | 0.002 | 7.565 | 0.002 | 104.83 | 0.02 | 83.47 | 0.02 | 119.93 | 0.02 | 897.3 | 0.4 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C16 H20 Cu N4 O7 - | - C16 H20 Cu N4 O7 - | - C32 H40 Cu2 N8 O14 - | 2 | 1 | MU0252 | Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R. | Mixed chelate complexes. II. Structures of <small>L</small>-alaninato(aqua)(4,7-diphenyl-1,10-phenanthroline)copper(II) nitrite monohydrate and aqua(4,7-dimethyl-1,10-phenanthroline)(glycinato)(nitrato)copper(II) monohydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 890 | 893 | 10.1107/S0108270192000556 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R.
Mixed chelate complexes. II. Structures of <small>L</small>-alaninato(aqua)(4,7-diphenyl-1,10-phenanthroline)copper(II) nitrite monohydrate and aqua(4,7-dimethyl-1,10-phenanthroline)(glycinato)(nitrato)copper(II) monohydrate
Acta Crystallographi... | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,001,676 | 12.2783 | 0.0008 | 21.5387 | 0.0006 | 41.9626 | 0.0002 | 90 | null | 90 | null | 90 | null | 11,097.4 | 0.8 | null | null | null | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | null | - C58 H58 Cl4 P4 W2 - | - C58 H52 Cl4 P4 W2 - | - C464 H416 Cl32 P32 W16 - | 8 | 1 | HH1033 | Cotton, F. A.; Eglin, J. L.; James, C. A. | Structural characterization of W^4^—WCl~4~(PMePh~2~)~4~ | Acta Crystallographica Section C | 1,993 | 49 | 5 | 893 | 896 | 10.1107/S0108270193000666 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Cotton, F. A.; Eglin, J. L.; James, C. A.
Structural characterization of W^4^—WCl~4~(PMePh~2~)~4~
Acta Crystallographica Section C
49(5)
(1993)
893-896 | 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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2,001,677 | 12.032 | 0.004 | 10.724 | 0.004 | 9.502 | 0.003 | 90 | null | 90 | null | 90 | null | 1,226.1 | 0.7 | null | null | null | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | null | - C11 H14 Cl N O3 - | - C11 H14 Cl N O3 - | - C44 H56 Cl4 N4 O12 - | 4 | 1 | MU1001 | Hajjem, B.; Kallel, A.; Svoboda, I.; Baccar, B. | Structure of <i>N</i>-[(4-chlorophenyl)di(methoxy)methyl]acetamide | Acta Crystallographica Section C | 1,993 | 49 | 5 | 898 | 900 | 10.1107/S0108270192012046 | 0.71069 | MO | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Hajjem, B.; Kallel, A.; Svoboda, I.; Baccar, B.
Structure of <i>N</i>-[(4-chlorophenyl)di(methoxy)methyl]acetamide
Acta Crystallographica Section C
49(5)
(1993)
898-900 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,001,678 | 8.959 | 0.001 | 14.137 | 0.001 | 13.934 | 0.001 | 90 | null | 90 | null | 90 | null | 1,764.8 | 0.3 | null | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C21 H28 N2 - | - C21 H28 N2 - | - C84 H112 N8 - | 4 | 1 | HU1008 | Katrusiak, A. | Structure of 15-phenyl-14-dehydrosparteine | Acta Crystallographica Section C | 1,993 | 49 | 5 | 900 | 902 | 10.1107/S0108270192012708 | 1.54178 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Katrusiak, A.
Structure of 15-phenyl-14-dehydrosparteine
Acta Crystallographica Section C
49(5)
(1993)
900-902 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,001,679 | 20.449 | 0.004 | 11.473 | 0.002 | 13.025 | 0.002 | 90 | null | 108.91 | 0.01 | 90 | null | 2,890.9 | 0.9 | null | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | null | - C20 H15 Cl - | - C20 H15 Cl - | - C160 H120 Cl8 - | 8 | 2 | CR0405 | Carrell, H. L. | 7-Chloromethyl-12-methylbenz[<i>a</i>]anthracene | Acta Crystallographica Section C | 1,993 | 49 | 5 | 902 | 905 | 10.1107/S0108270192008278 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Carrell, H. L.
7-Chloromethyl-12-methylbenz[<i>a</i>]anthracene
Acta Crystallographica Section C
49(5)
(1993)
902-905 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,063,475 | 15.6908 | 0.0002 | 11.1879 | 0.0002 | 17.9775 | 0.0003 | 90 | null | 96.9448 | 0.0014 | 90 | null | 3,132.74 | 0.09 | 150 | 2 | 150 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C35 H31 Cl2 N2 P Pd - | - C35 H31 Cl2 N2 P Pd - | - C140 H124 Cl8 N8 P4 Pd4 - | 4 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.0307 | 0.0228 | null | null | 0.0556 | 0.0568 | null | null | null | null | null | 1.035 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-21 06:41:29 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178529 $
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2,001,680 | 24.113 | 0.005 | 11.02 | 0.005 | 12.065 | 0.004 | 90 | null | 100.07 | 0.02 | 90 | null | 3,156.6 | 1.9 | null | null | null | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | null | - C30 H36 N3 O4 S3 - | - C33.5 H29 N3 O4 S3 - | - C134 H116 N12 O16 S12 - | 4 | 1 | AL1031 | Evans, D. J.; Hughes, D. L.; Leigh, G. J.; Garcia, G.; Santana, M. D. | Structure of 4,7-bis(4-mercaptobenzoyl)-1-tosyl-1,4,7-triazacyclononane | Acta Crystallographica Section C | 1,993 | 49 | 5 | 905 | 908 | 10.1107/S0108270192012770 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Evans, D. J.; Hughes, D. L.; Leigh, G. J.; Garcia, G.; Santana, M. D.
Structure of 4,7-bis(4-mercaptobenzoyl)-1-tosyl-1,4,7-triazacyclononane
Acta Crystallographica Section C
49(5)
(1993)
905-908 | 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/2/00/16/2001680.cif $
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2,001,681 | 9.114 | 0.007 | 18.747 | 0.011 | 14.185 | 0.009 | 90 | null | 104.57 | 0.06 | 90 | null | 2,346 | 3 | null | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C24 H39 Cl N2 O3 - | - C24 H38 Cl N2 O3 - | - C96 H152 Cl4 N8 O12 - | 4 | 1 | DU0340 | Kettmann, V.; Frešová, E.; Sivý, J.; Gregáň, F. | Structure of <i>trans</i>-1-{2-[(2-butoxy)phenylcarbamoyloxy]cycloheptylmethyl}piperidinium chloride | Acta Crystallographica Section C | 1,993 | 49 | 5 | 908 | 911 | 10.1107/S0108270192012459 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Kettmann, V.; Frešová, E.; Sivý, J.; Gregáň, F.
Structure of <i>trans</i>-1-{2-[(2-butoxy)phenylcarbamoyloxy]cycloheptylmethyl}piperidinium chloride
Acta Crystallographica Section C
49(5)
(1993)
908-911 | 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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2,001,682 | 8.756 | 0.004 | 12.373 | 0.006 | 8.426 | 0.005 | 102.99 | 0.03 | 115.79 | 0.03 | 98.06 | 0.03 | 770.9 | 0.8 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C17 H16 N6 O4 - | - C17 H16 N6 O4 - | - C34 H32 N12 O8 - | 2 | 1 | AL1019 | Agmon, I.; Ashkenazi, P.; Kaftory, M. | Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene | Acta Crystallographica Section C | 1,993 | 49 | 5 | 911 | 914 | 10.1107/S0108270192012241 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Agmon, I.; Ashkenazi, P.; Kaftory, M.
Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene
Acta Crystallographica Section C
49(5)
(1993)
911-914 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,001,683 | 14.44 | 0.007 | 9.416 | 0.005 | 16.227 | 0.009 | 90 | null | 98.42 | 0.03 | 90 | null | 2,183 | 2 | null | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C27 H20 N6 O4 - | - C27 H20 N6 O4 - | - C108 H80 N24 O16 - | 4 | 1 | AL1019 | Agmon, I.; Ashkenazi, P.; Kaftory, M. | Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene | Acta Crystallographica Section C | 1,993 | 49 | 5 | 911 | 914 | 10.1107/S0108270192012241 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Agmon, I.; Ashkenazi, P.; Kaftory, M.
Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene
Acta Crystallographica Section C
49(5)
(1993)
911-914 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,684 | 12.673 | 0.006 | 11.431 | 0.006 | 9.439 | 0.005 | 68.49 | 0.03 | 111.39 | 0.03 | 97.72 | 0.03 | 1,184.5 | 1.1 | null | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C28 H23 N6 O5 - | - C28 H22 N6 O5 - | - C56 H44 N12 O10 - | 2 | 1 | AL1019 | Agmon, I.; Ashkenazi, P.; Kaftory, M. | Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene | Acta Crystallographica Section C | 1,993 | 49 | 5 | 911 | 914 | 10.1107/S0108270192012241 | 0.71069 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Agmon, I.; Ashkenazi, P.; Kaftory, M.
Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene
Acta Crystallographica Section C
49(5)
(1993)
911-914 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
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4,063,474 | 11.5499 | 0.0004 | 16.3133 | 0.0006 | 19.19 | 0.0007 | 90 | null | 96.712 | 0.001 | 90 | null | 3,590.9 | 0.2 | 150 | 2 | 150 | 2 | null | null | null | null | 7 | P 1 21/n 1 | -P 2yn | 14 | - C38 H40 Br2 N3 O P Pd - | - C38 H40 Br2 N3 O P Pd - | - C152 H160 Br8 N12 O4 P4 Pd4 - | 4 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.0288 | 0.0224 | null | null | 0.0572 | 0.0594 | null | null | null | null | null | 1.028 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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#$Revision: 178529 $
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2,001,685 | 7.349 | 0.001 | 10.613 | 0.002 | 11.721 | 0.002 | 84.42 | 0.01 | 79.42 | 0.01 | 83.23 | 0.01 | 889.7 | 0.3 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C16 H12 Cl4 N2 O3 - | - C16 H12 Cl4 N2 O3 - | - C32 H24 Cl8 N4 O6 - | 2 | 1 | GR0204 | Toma, P. H.; Nguyen, D. N.; Byrn, S. R. | 9-Chloro-2-ethoxy-6-nitroacridine | Acta Crystallographica Section C | 1,993 | 49 | 5 | 914 | 916 | 10.1107/S0108270192011909 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Toma, P. H.; Nguyen, D. N.; Byrn, S. R.
9-Chloro-2-ethoxy-6-nitroacridine
Acta Crystallographica Section C
49(5)
(1993)
914-916 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,686 | 5.322 | 0.002 | 10.531 | 0.003 | 12.939 | 0.002 | 90 | null | 99.2 | 0.02 | 90 | null | 715.9 | 0.4 | null | null | null | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C10 H16 N4 Se3 - | - C10 H16 N4 Se3 - | - C20 H32 N8 Se6 - | 2 | 1 | AB1012 | Billing, D. G.; Ferg, E. E.; Lai, L.-L.; Levendis, D. C.; Reid, D. H. | Structures of 2,3-diethyl-6,7-dihydro-5<i>H</i>-2aλ^4^-selena-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(3<i>H</i>)-diselone and 1,4-bis(ethylimino)-5,6-dihydro-2,2aλ^4^,3-triselena-4a,6a-diazacyclopenta[<i>cd</i>]pentalene | Acta Crystallographica Section C | 1,993 | 49 | 5 | 917 | 921 | 10.1107/S0108270192011582 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Billing, D. G.; Ferg, E. E.; Lai, L.-L.; Levendis, D. C.; Reid, D. H.
Structures of 2,3-diethyl-6,7-dihydro-5<i>H</i>-2aλ^4^-selena-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(3<i>H</i>)-diselone and 1,4-bis(ethylimino)-5,6-dihydro-2,2aλ^4^,3-triselena-4a,6a-diazacyclopenta[<i>cd</i>]pentalene
Acta Crys... | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,687 | 8.005 | 0.001 | 13.717 | 0.002 | 11.95 | 0.001 | 90 | null | 93.42 | 0.01 | 90 | null | 1,309.8 | 0.3 | null | null | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | null | - C9 H14 N4 Se3 - | - C9 H14 N4 Se3 - | - C36 H56 N16 Se12 - | 4 | 1 | AB1012 | Billing, D. G.; Ferg, E. E.; Lai, L.-L.; Levendis, D. C.; Reid, D. H. | Structures of 2,3-diethyl-6,7-dihydro-5<i>H</i>-2aλ^4^-selena-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(3<i>H</i>)-diselone and 1,4-bis(ethylimino)-5,6-dihydro-2,2aλ^4^,3-triselena-4a,6a-diazacyclopenta[<i>cd</i>]pentalene | Acta Crystallographica Section C | 1,993 | 49 | 5 | 917 | 921 | 10.1107/S0108270192011582 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Billing, D. G.; Ferg, E. E.; Lai, L.-L.; Levendis, D. C.; Reid, D. H.
Structures of 2,3-diethyl-6,7-dihydro-5<i>H</i>-2aλ^4^-selena-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(3<i>H</i>)-diselone and 1,4-bis(ethylimino)-5,6-dihydro-2,2aλ^4^,3-triselena-4a,6a-diazacyclopenta[<i>cd</i>]pentalene
Acta Crys... | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,688 | 5.659 | 0.002 | 15.097 | 0.003 | 17.138 | 0.005 | 90 | null | 96.7 | 0.3 | 90 | null | 1,454.2 | 1.2 | null | null | null | null | null | null | null | null | 4 | P 1 21 1 | null | - C28 H33 N9 O10 - | - C28 H33 N9 O10 - | - C56 H66 N18 O20 - | 2 | 1 | GR1001 | Bhat, B.; Wilson, S. R.; Leonard, N. J. | Structure of a covalently linked cross-section representative of a hydrogen-bonded dA^. ^dT base pair | Acta Crystallographica Section C | 1,993 | 49 | 5 | 921 | 924 | 10.1107/S0108270192012009 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Bhat, B.; Wilson, S. R.; Leonard, N. J.
Structure of a covalently linked cross-section representative of a hydrogen-bonded dA^. ^dT base pair
Acta Crystallographica Section C
49(5)
(1993)
921-924 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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4,063,473 | 15.7 | 0.004 | 18.927 | 0.005 | 21.459 | 0.005 | 90 | null | 90 | null | 90 | null | 6,377 | 3 | 150 | 2 | 150 | 2 | null | null | null | null | 6 | P b c a | -P 2ac 2ab | 61 | - C35 H33 Cl2 N2 P Pd - | - C35 H33 Cl2 N2 P Pd - | - C280 H264 Cl16 N16 P8 Pd8 - | 8 | 1 | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man | Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes | Organometallics | 2,010 | 29 | 2 | 463 | 472 | 10.1021/om9009203 | x-ray | 0.71073 | MoKα | 0.2059 | 0.0622 | null | null | 0.1286 | 0.1767 | null | null | null | null | null | 0.88 | null | null | has coordinates | Chan, Kai-Ting; Tsai, Yi-Hua; Lin, Wu-Shien; Wu, Jia-Rong; Chen, Shih-Jung; Liao, Fu-Xing; Hu, Ching-Han; Lee, Hon Man
Palladium Complexes with Carbene and Phosphine Ligands: Synthesis, Structural Characterization, and Direct Arylation Reactions between Aryl Halides and Alkynes
Organometallics
29(2)
(2010)
463-472 | 178,529 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,689 | 10.0317 | 0.0001 | 5.8539 | 0.0001 | 4.6768 | 0.0001 | 90 | null | 90 | null | 90 | null | 274.643 | 0.008 | null | null | null | null | null | null | null | null | 4 | P n m a | -P 2ac 2n | 62 | - Li Ni O4 P - | - Li Ni O4 P - | - Li4 Ni4 O16 P4 - | 4 | 0.5 | HA1024 | Abrahams, I.; Easson, K. S. | Structure of lithium nickel phosphate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 925 | 926 | 10.1107/S0108270192013064 | 1.54056 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Abrahams, I.; Easson, K. S.
Structure of lithium nickel phosphate
Acta Crystallographica Section C
49(5)
(1993)
925-926 | 278,244 | 2022-09-28 | 13:56:22 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 16:56:03 +0300 (Wed, 28 Sep 2022) $
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2,001,690 | 6.334 | 0.001 | 14.204 | 0.001 | 14.215 | 0.001 | 90 | null | 100.72 | 0.01 | 90 | null | 1,256.6 | 0.2 | null | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C6 H10 Cl3 N5 O Zn - | - C6 H10 Cl3 N5 O Zn - | - C24 H40 Cl12 N20 O4 Zn4 - | 4 | 1 | LI1022 | Maixner, J.; Zachová, J. | Structure of trichloro(9-methyladeninium)zinc(II) monohydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 927 | 929 | 10.1107/S0108270192010837 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Maixner, J.; Zachová, J.
Structure of trichloro(9-methyladeninium)zinc(II) monohydrate
Acta Crystallographica Section C
49(5)
(1993)
927-929 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
#$Date: 2022-10-03 17:40:12 +0300 (Mon, 03 Oct 2022) $
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2,001,691 | 15.427 | 0.002 | 8.323 | 0.003 | 11.772 | 0.005 | 90 | null | 90 | null | 90 | null | 1,511.5 | 0.9 | null | null | null | null | null | null | null | null | 5 | P c a 21 | P 2c -2ac | null | - C16 H15 N S U - | - C16 H15 N S U - | - C64 H60 N4 S4 U4 - | 4 | 1 | MU1000 | Spirlet, M. R.; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B. | Structure of tris(η^5^-cyclopentadienyl)uranium thiocyanate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 929 | 931 | 10.1107/S0108270192011211 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Spirlet, M. R.; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B.
Structure of tris(η^5^-cyclopentadienyl)uranium thiocyanate
Acta Crystallographica Section C
49(5)
(1993)
929-931 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,001,692 | 11.813 | 0.004 | 8.353 | 0.005 | 12.297 | 0.004 | 90 | null | 102.31 | 0.03 | 90 | null | 1,185.5 | 0.9 | null | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C14 H14 Fe O2 - | - C14 H14 Fe O2 - | - C56 H56 Fe4 O8 - | 4 | 1 | HH0554 | Zhu, Y. | Structure of 3-ferrocenyl-2-butenoic acid | Acta Crystallographica Section C | 1,993 | 49 | 5 | 931 | 932 | 10.1107/S0108270192006632 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Zhu, Y.
Structure of 3-ferrocenyl-2-butenoic acid
Acta Crystallographica Section C
49(5)
(1993)
931-932 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,001,693 | 4.9016 | 0.0008 | 7.975 | 0.001 | 8.413 | 0.007 | 100.4 | 0.01 | 102.417 | 0.001 | 94.083 | 0.001 | 313.8 | 0.3 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C4 H10 Cl N O - | - C4 H10 Cl N O - | - C8 H20 Cl2 N2 O2 - | 2 | 1 | AB1008 | Bentzen, S.; Nielsen, P. H.; Anthoni, U.; Christophersen, C.; Gajhede, M. | 3-Methoxyazetidinium chloride | Acta Crystallographica Section C | 1,993 | 49 | 5 | 932 | 934 | 10.1107/S0108270192009314 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Bentzen, S.; Nielsen, P. H.; Anthoni, U.; Christophersen, C.; Gajhede, M.
3-Methoxyazetidinium chloride
Acta Crystallographica Section C
49(5)
(1993)
932-934 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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7,106,561 | 8.0268 | 0.0005 | 8.9535 | 0.0006 | 16.5775 | 0.0015 | 95.856 | 0.003 | 97.077 | 0.004 | 112.65 | 0.004 | 1,076.5 | 0.14 | 293 | null | 293 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | catena-poly-[bis(u2-selenocyanato-k2N:S)-bis(pyridine-kN)cobalt(II)] | - C12 H10 Co N4 Se2 - | - C12 Co N4 Se2 - | - C36 Co3 N12 Se6 - | 3 | 1.5 | Jan Boeckmann; Christian Nather | Rational route to SCM materials based on 1-D cobalt selenocyanato coordination polymer | Chem. Commun. | 2,011 | 47 | 7104 | 10.1039/c1cc12273h | powder diffraction | 1.54056 | CuKα | null | null | null | null | null | null | null | 6.7157 | null | null | null | null | null | null | has coordinates | Jan Boeckmann; Christian Nather
Rational route to SCM materials based on 1-D cobalt selenocyanato coordination polymer
Chem. Commun.
47
(2011)
7104 | 180,169 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,694 | 7.732 | 0.002 | 9.533 | 0.003 | 14.725 | 0.005 | 90 | null | 90 | null | 90 | null | 1,085.4 | 0.6 | null | null | null | null | null | null | null | null | 4 | P 21 a b | P -2b 2a | null | - C9 H16 O2 S2 - | - C9 H16 O2 S2 - | - C36 H64 O8 S8 - | 4 | 1 | SE1014 | Brunck, J.-S.; Voss, J.; Olbrich, F.; Viebrock, H. | Structure and configuration of the Michael adduct of 2-(methylthio)thiolane <i>S</i>-oxide and butenone at 173 K | Acta Crystallographica Section C | 1,993 | 49 | 5 | 934 | 936 | 10.1107/S0108270192013350 | 1.54051 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Brunck, J.-S.; Voss, J.; Olbrich, F.; Viebrock, H.
Structure and configuration of the Michael adduct of 2-(methylthio)thiolane <i>S</i>-oxide and butenone at 173 K
Acta Crystallographica Section C
49(5)
(1993)
934-936 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,695 | 17.32 | 0.002 | 17.32 | 0.002 | 16.963 | 0.002 | 90 | null | 90 | null | 120 | null | 4,406.9 | 0.9 | null | null | null | null | null | null | null | null | 4 | R 3 2 :H | R 3 2" | 155 | - C10 H17 Cl N - | - C10 H17.5 Cl0.5 N - | - C180 H315 Cl9 N18 - | 18 | 1 | ST0476 | Abboud, K. A.; Davis, R. E.; Chen, K.-M.; Whitesell, J. K. | Structure at 198 K of a chiral tricyclic aminochloride, C~10~H~17~N.0.5HCl | Acta Crystallographica Section C | 1,993 | 49 | 5 | 936 | 938 | 10.1107/S0108270192012502 | 0.71069 | mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Abboud, K. A.; Davis, R. E.; Chen, K.-M.; Whitesell, J. K.
Structure at 198 K of a chiral tricyclic aminochloride, C~10~H~17~N.0.5HCl
Acta Crystallographica Section C
49(5)
(1993)
936-938 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,696 | 6.023 | 0.002 | 8.007 | 0.003 | 20.877 | 0.009 | 90 | null | 90 | null | 90 | null | 1,006.8 | 0.7 | null | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C12 H9 N Te - | - C12 H9 N Te - | - C48 H36 N4 Te4 - | 4 | 1 | ST1023 | Junk, T.; Irgolic, K. J.; Reibenspies, J. H.; Meyers, E. A. | Structure of phenotellurazine | Acta Crystallographica Section C | 1,993 | 49 | 5 | 938 | 940 | 10.1107/S0108270192011004 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Junk, T.; Irgolic, K. J.; Reibenspies, J. H.; Meyers, E. A.
Structure of phenotellurazine
Acta Crystallographica Section C
49(5)
(1993)
938-940 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,001,697 | 11.423 | 0.002 | 12.193 | 0.002 | 6.601 | 0.005 | 81 | 0.03 | 104.04 | 0.03 | 103.052 | 0.012 | 863.8 | 0.7 | null | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C14 H22 N2 O2 S Si - | - C14 H22 N2 O2 S Si - | - C28 H44 N4 O4 S2 Si2 - | 2 | 1 | GR0202 | Negron, A.; Barnes, C. L.; Soderquist, J. A. | 1,1-Dimethyl-1-silacyclohexan-4-one tosylhydrazone | Acta Crystallographica Section C | 1,993 | 49 | 5 | 940 | 942 | 10.1107/S0108270192012034 | 0.71073 | Mo | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Negron, A.; Barnes, C. L.; Soderquist, J. A.
1,1-Dimethyl-1-silacyclohexan-4-one tosylhydrazone
Acta Crystallographica Section C
49(5)
(1993)
940-942 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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7,106,560 | 12.5221 | 0.0005 | 13.2875 | 0.0007 | 15.2441 | 0.0006 | 90 | null | 108.418 | 0.003 | 90 | null | 2,406.5 | 0.19 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | - C22 H20 Co N6 Se2 - | - C22 H20 Co N6 Se2 - | - C88 H80 Co4 N24 Se8 - | 4 | 0.5 | Jan Boeckmann; Christian Nather | Rational route to SCM materials based on 1-D cobalt selenocyanato coordination polymer | Chem. Commun. | 2,011 | 47 | 7104 | 10.1039/c1cc12273h | 0.71073 | MoKα | 0.0753 | 0.0592 | null | null | 0.113 | 0.1183 | null | null | null | null | null | 1.237 | null | null | has coordinates | Jan Boeckmann; Christian Nather
Rational route to SCM materials based on 1-D cobalt selenocyanato coordination polymer
Chem. Commun.
47
(2011)
7104 | 301,853 | 2025-08-21 | 21:50:04 | #------------------------------------------------------------------------------
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2,001,698 | 9.696 | 0.003 | 11.322 | 0.004 | 7.076 | 0.003 | 100.68 | 0.04 | 93.4 | 0.03 | 107.04 | 0.04 | 724.5 | 0.5 | null | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C12 H18 Cl2 N2 O2 - | - C12 H18 Cl2 N2 O2 - | - C24 H36 Cl4 N4 O4 - | 2 | 1 | PA0264 | Cousson, A.; Bachet, B.; Kokel, B.; Hubert-Habart, M. | Structure of <i>N</i>,<i>N</i>'-dimethyl-4,4'-bipyridylium dichloride dihydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 942 | 943 | 10.1107/S0108270191015019 | 1.5418 | Cu | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Cousson, A.; Bachet, B.; Kokel, B.; Hubert-Habart, M.
Structure of <i>N</i>,<i>N</i>'-dimethyl-4,4'-bipyridylium dichloride dihydrate
Acta Crystallographica Section C
49(5)
(1993)
942-943 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,699 | 11.6918 | 0.0004 | 6.407 | 0.0002 | 6.6988 | 0.0002 | 90 | null | 105.55 | 0.001 | 90 | null | 483.44 | 0.03 | 300 | null | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | null | - Cl2 D4 O2 Sr - | - Cl2 D4 O2 Sr - | - Cl8 D16 O8 Sr4 - | 4 | 0.5 | SH1018 | Möller, H.; Lutz, H. D. | Profile structure refinement of SrCl~2~.2D~2~O by neutron powder diffraction | Acta Crystallographica Section C | 1,993 | 49 | 5 | 944 | 946 | 10.1107/S0108270192011806 | neutron | 1.2268 | neutron | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Möller, H.; Lutz, H. D.
Profile structure refinement of SrCl~2~.2D~2~O by neutron powder diffraction
Acta Crystallographica Section C
49(5)
(1993)
944-946 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,001,700 | 11.7008 | 0.0004 | 6.3697 | 0.0002 | 6.6477 | 0.0002 | 90 | null | 105.978 | 0.002 | 90 | null | 476.32 | 0.03 | 1.5 | null | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | null | - Cl2 D4 O2 Sr - | - Cl2 D4 O2 Sr - | - Cl8 D16 O8 Sr4 - | 4 | 0.5 | SH1018 | Möller, H.; Lutz, H. D. | Profile structure refinement of SrCl~2~.2D~2~O by neutron powder diffraction | Acta Crystallographica Section C | 1,993 | 49 | 5 | 944 | 946 | 10.1107/S0108270192011806 | neutron | 1.2268 | neutron | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Möller, H.; Lutz, H. D.
Profile structure refinement of SrCl~2~.2D~2~O by neutron powder diffraction
Acta Crystallographica Section C
49(5)
(1993)
944-946 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,701 | 7.2 | 0.002 | 7.477 | 0.002 | 9.144 | 0.003 | 90 | null | 108.95 | 0.01 | 90 | null | 465.6 | 0.2 | 291 | 1 | null | null | null | null | null | null | 3 | P 1 21/m 1 | -P 2yb | 11 | - Br4 K2 Zn - | - Br4 K2 Zn - | - Br8 K4 Zn2 - | 2 | 0.5 | AL9484 | Fábry, J.; Breczewski, T.; Zúñiga, F. J.; Arnaiz, A. R. | Structure determination of K~2~ZnBr~4~ at 291 and 144 K | Acta Crystallographica Section C | 1,993 | 49 | 5 | 946 | 950 | 10.1107/S0108270192009508 | 1.54056 | CuKαradiationforpowderdiffraction | null | 0.0282 | null | null | 0.0315 | null | null | null | null | 1.123 | 1.123 | null | null | null | has coordinates | Fábry, J.; Breczewski, T.; Zúñiga, F. J.; Arnaiz, A. R.
Structure determination of K~2~ZnBr~4~ at 291 and 144 K
Acta Crystallographica Section C
49(5)
(1993)
946-950 | 205,956 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-01-31 13:05:05 +0200 (Wed, 31 Jan 2018) $
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2,001,702 | 7.204 | 0.003 | 7.413 | 0.004 | 9.028 | 0.005 | 90 | null | 108.67 | 0.03 | 90 | null | 456.8 | 0.4 | 144 | 3 | null | null | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | - Br4 K2 Zn - | - Br4 K2 Zn - | - Br8 K4 Zn2 - | 2 | 1 | AL9484 | Fábry, J.; Breczewski, T.; Zúñiga, F. J.; Arnaiz, A. R. | Structure determination of K~2~ZnBr~4~ at 291 and 144 K | Acta Crystallographica Section C | 1,993 | 49 | 5 | 946 | 950 | 10.1107/S0108270192009508 | 1.54056 | CuKαradiationforpowderdiffraction | null | 0.0493 | null | null | 0.0597 | null | null | null | null | 1.318 | 1.318 | null | null | null | has coordinates | Fábry, J.; Breczewski, T.; Zúñiga, F. J.; Arnaiz, A. R.
Structure determination of K~2~ZnBr~4~ at 291 and 144 K
Acta Crystallographica Section C
49(5)
(1993)
946-950 | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-01-30 16:30:45 +0200 (Tue, 30 Jan 2018) $
#$Revision: 205898 $
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7,106,559 | 21.222 | 0.019 | 17.716 | 0.016 | 14.376 | 0.013 | 90 | null | 127.821 | 0.009 | 90 | null | 4,270 | 7 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/m 1 | -C 2y | 12 | - C21 H25 N4 O10 Zn2 - | - C21 H16 N4 O10 Zn2 - | - C84 H64 N16 O40 Zn8 - | 4 | 0.5 | Yun Ling,; Zhen-Xia Chen; Fu-Peng Zhai; Ya-Ming Zhou; Lin-Hong Weng; Dong-Yuan Zhao | A zinc(II) metal-organic framework based on triazole and dicarboxylate ligands for selective adsorption of hexane isomers | Chem.Commun. | 2,011 | 47 | 7197 | 10.1039/c1cc12253c | 0.71073 | MoKα | 0.1251 | 0.0816 | null | null | 0.2263 | 0.2674 | null | null | null | null | null | 1.08 | null | null | has coordinates | Yun Ling,; Zhen-Xia Chen; Fu-Peng Zhai; Ya-Ming Zhou; Lin-Hong Weng; Dong-Yuan Zhao
A zinc(II) metal-organic framework based on triazole and dicarboxylate ligands for selective adsorption of hexane isomers
Chem.Commun.
47
(2011)
7197 | 180,169 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,001,703 | 10.255 | 0.001 | 10.26 | 0.002 | 14.466 | 0.004 | 75.87 | 0.03 | 96.81 | 0.02 | 118.44 | 0.01 | 1,297.9 | 0.5 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - K8 Mo6 O24 Th - | - K8 Mo6 O24 Th - | - K16 Mo12 O48 Th2 - | 2 | 1 | DU1012 | Huyghe, M.; Lee, M.-R.; Jaulmes, S.; Quarton, M. | Structure de K~8~Th(MoO~4~)~6~ | Acta Crystallographica Section C | 1,993 | 49 | 5 | 950 | 954 | 10.1107/S0108270192012204 | 0.71069 | MoKα | null | 0.068 | null | null | 0.064 | null | null | null | null | 1.89 | 1.89 | null | null | null | has coordinates | Huyghe, M.; Lee, M.-R.; Jaulmes, S.; Quarton, M.
Structure de K~8~Th(MoO~4~)~6~
Acta Crystallographica Section C
49(5)
(1993)
950-954 | 278,247 | 2022-09-28 | 15:09:31 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,001,704 | 14.863 | 0.003 | 15.751 | 0.003 | 11.94 | 0.003 | 90 | null | 122.51 | 0.01 | 90 | null | 2,357.2 | 0.9 | 213 | 1 | null | null | null | null | null | null | 4 | C 1 c 1 | C -2yc | null | - C26 H34 O2 Sn - | - C26 H34 O2 Sn - | - C104 H136 O8 Sn4 - | 4 | 1 | SH1008 | Reuter, H.; Schröder, D. | Triphenyltin(IV) isobutoxide isobutanol solvate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 954 | 956 | 10.1107/S0108270192011569 | 0.71 | MoKα | null | 0.023 | null | null | 0.062 | null | null | null | null | 1.029 | 1.029 | null | null | null | has coordinates | Reuter, H.; Schröder, D.
Triphenyltin(IV) isobutoxide isobutanol solvate
Acta Crystallographica Section C
49(5)
(1993)
954-956 | 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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2,001,705 | 9.146 | 0.004 | 8.65 | 0.004 | 6.622 | 0.003 | 109.05 | 0.04 | 71.05 | 0.04 | 109.03 | 0.05 | 453.9 | 0.4 | 295 | 2 | null | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C8 H10 Br2 Cl4 N6 O2 Pd - | - C8 H10 Br2 Cl4 N6 O2 Pd - | - C8 H10 Br2 Cl4 N6 O2 Pd - | 1 | 0.5 | NA1012 | Casellato, U.; Ettorre, R.; Graziani, R. | Bis(5-bromocytosinium) tetrachloropalladate(II) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 956 | 957 | 10.1107/S0108270192011429 | 0.7107 | MoKα | null | 0.031 | null | null | 0.031 | null | null | null | null | 0.777 | 0.777 | null | null | null | has coordinates | Casellato, U.; Ettorre, R.; Graziani, R.
Bis(5-bromocytosinium) tetrachloropalladate(II)
Acta Crystallographica Section C
49(5)
(1993)
956-957 | 277,834 | 2022-09-14 | 16:39:43 | #------------------------------------------------------------------------------
#$Date: 2022-09-14 19:38:48 +0300 (Wed, 14 Sep 2022) $
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2,001,706 | 15.352 | 0.002 | 18.876 | 0.004 | 18.423 | 0.004 | 90 | null | 103.71 | 0.01 | 90 | null | 5,186.6 | 1.7 | 293 | null | 293 | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | 2-(η^2^-Dithioformato)-2-(triphenylphosphine)-1,7-dicarba-2-rhoda-closo- dodecaborane(12) | - C22 H27 B9 P Rh S2 - | - C21 H27 B9 P Rh S2 - | - C168 H216 B72 P8 Rh8 S16 - | 8 | 2 | AB1043 | Ferguson, G.; Couglan, S.; Spalding, T. R. | 2-(η^2^-Dithioformato)-2-(triphenylphosphine)-1,7-dicarba-2-rhoda-<i>closo</i>-dodecaborane(12) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 957 | 961 | 10.1107/S010827019201223X | 0.7093 | MolybdenumKα | null | 0.027 | null | null | 0.038 | null | null | null | null | 1.44 | 1.44 | null | null | null | has coordinates | Ferguson, G.; Couglan, S.; Spalding, T. R.
2-(η^2^-Dithioformato)-2-(triphenylphosphine)-1,7-dicarba-2-rhoda-<i>closo</i>-dodecaborane(12)
Acta Crystallographica Section C
49(5)
(1993)
957-961 | 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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2,001,707 | 9.822 | 0.005 | 13.676 | 0.007 | 13.998 | 0.004 | 90 | null | 96.86 | 0.03 | 90 | null | 1,866.8 | 1.5 | 298 | 3 | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C10 H25 Cl2 N5 Ni O8 - | - C10 H25 Cl2 N5 Ni O9 - | - C40 H100 Cl8 N20 Ni4 O36 - | 4 | 1 | AS1020 | Lu, T.-H.; Lan, W.-J.; Chung, C.-S. | Structure of (1,4,7,10,13-Pentaazacyclopentadecane-<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^10^,<i>N</i>^13^)(perchlorato-<i>O</i>)nickel(II) perchlorate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 961 | 963 | 10.1107/S0108270192011405 | 0.7093 | MoKα | null | 0.066 | null | null | 0.074 | null | null | null | null | 2.03 | 2.03 | null | null | null | has coordinates | Lu, T.-H.; Lan, W.-J.; Chung, C.-S.
Structure of (1,4,7,10,13-Pentaazacyclopentadecane-<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^10^,<i>N</i>^13^)(perchlorato-<i>O</i>)nickel(II) perchlorate
Acta Crystallographica Section C
49(5)
(1993)
961-963 | 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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7,106,558 | 13.207 | 0.002 | 22.515 | 0.003 | 15.273 | 0.002 | 90 | null | 106.601 | 0.002 | 90 | null | 4,352.2 | 1 | 100 | 2 | 100 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C44 H63 Cl Ge2 N4 - | - C44 H63 Cl Ge2 N4 - | - C176 H252 Cl4 Ge8 N16 - | 4 | 1 | Sankaranarayana Pillai Sarish; Sakya S. Sen; Herbert W. Roesky; Ina Objartel; Dietmar Stalke | Elegant approach to spacer arranged silagermylene and bis(germylene) compounds | Chem.Commun. | 2,011 | 47 | 7206 | 10.1039/c1cc12205c | 0.71073 | MoKα | 0.0459 | 0.0325 | null | null | 0.0642 | 0.069 | null | null | null | null | null | 1.038 | null | null | has coordinates | Sankaranarayana Pillai Sarish; Sakya S. Sen; Herbert W. Roesky; Ina Objartel; Dietmar Stalke
Elegant approach to spacer arranged silagermylene and bis(germylene) compounds
Chem.Commun.
47
(2011)
7206 | 301,853 | 2025-08-21 | 21:50:04 | #------------------------------------------------------------------------------
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2,001,708 | 8.7974 | 0.0005 | 11.8717 | 0.0007 | 10.779 | 0.0009 | 90 | null | 108.212 | 0.005 | 90 | null | 1,069.37 | 0.13 | 293 | null | 293 | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C8 H24 F8 O4 S4 Zr2 - | - C8 H24 F8 O4 S4 Zr2 - | - C16 H48 F16 O8 S8 Zr4 - | 2 | 0.5 | DU1016 | Gao, Y.; Guery, J.; Jacoboni, C. | Structures of [Zr~2~F~8~(dmso)~4~] and [ZrF~4~(dmso)(H~2~O)~2~].2H~2~O | Acta Crystallographica Section C | 1,993 | 49 | 5 | 963 | 965 | 10.1107/S0108270192012472 | 0.71073 | MoKα | null | 0.023 | null | null | 0.023 | null | null | null | null | 0.907 | 0.907 | null | null | null | has coordinates | Gao, Y.; Guery, J.; Jacoboni, C.
Structures of [Zr~2~F~8~(dmso)~4~] and [ZrF~4~(dmso)(H~2~O)~2~].2H~2~O
Acta Crystallographica Section C
49(5)
(1993)
963-965 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,001,709 | 7.357 | 0.004 | 8.318 | 0.004 | 9.627 | 0.005 | 99.95 | 0.02 | 98.76 | 0.02 | 108.61 | 0.02 | 536.2 | 0.5 | 293 | null | 293 | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C2 H14 F4 O5 S Zr - | - C2 H14 F4 O5 S Zr - | - C4 H28 F8 O10 S2 Zr2 - | 2 | 1 | DU1016 | Gao, Y.; Guery, J.; Jacoboni, C. | Structures of [Zr~2~F~8~(dmso)~4~] and [ZrF~4~(dmso)(H~2~O)~2~].2H~2~O | Acta Crystallographica Section C | 1,993 | 49 | 5 | 963 | 965 | 10.1107/S0108270192012472 | 0.71073 | MoKα | null | 0.021 | null | null | 0.021 | null | null | null | null | 2.21 | 2.21 | null | null | null | has coordinates | Gao, Y.; Guery, J.; Jacoboni, C.
Structures of [Zr~2~F~8~(dmso)~4~] and [ZrF~4~(dmso)(H~2~O)~2~].2H~2~O
Acta Crystallographica Section C
49(5)
(1993)
963-965 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,001,710 | 7.96 | 0.001 | 20.467 | 0.002 | 11.565 | 0.001 | 90 | null | 125.06 | 0.01 | 90 | null | 1,542.3 | 0.3 | 301 | null | 301 | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | dichlorobis-μ-{1-[4-chloro-(2-oxido-1:2κ^2^O')-phenyliminomethyl]naphalen- 2-olato}-1κ^2^N,O;2κ^2^N,O-diiron(III) | - C34 H20 Cl4 Fe2 N2 O4 - | - C34 H20 Cl4 Fe2 N2 O4 - | - C68 H40 Cl8 Fe4 N4 O8 - | 2 | 0.5 | SH1022 | Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H. | Structure of bis[chloro{1-[(4-chloro-2-hydroxyphenyl)iminomethyl]naphthalen-2-olato-<i>O</i>,<i>O</i>',<i>N</i>}iron(III)] | Acta Crystallographica Section C | 1,993 | 49 | 5 | 965 | 967 | 10.1107/S0108270192012228 | 0.71069 | MoKα | null | 0.0685 | null | null | 0.0489 | null | null | null | null | null | null | null | null | null | has coordinates | Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H.
Structure of bis[chloro{1-[(4-chloro-2-hydroxyphenyl)iminomethyl]naphthalen-2-olato-<i>O</i>,<i>O</i>',<i>N</i>}iron(III)]
Acta Crystallographica Section C
49(5)
(1993)
965-967 | 190,528 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-01-15 01:53:32 +0200 (Sun, 15 Jan 2017) $
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/17/2001710.cif $
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2,001,711 | 13.7594 | 0.0006 | 5.9786 | 0.0003 | 17.843 | 0.0012 | 90 | null | 106.115 | 0.005 | 90 | null | 1,410.12 | 0.14 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 1-Ferrocenyl-1-phenylethanol | racemic 1-Ferrocenyl-1-phenylethanol | - C18 H18 Fe O - | - C18 H17.35 Fe O - | - C72 H69.4 Fe4 O4 - | 4 | 1 | LI1034 | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M. | Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 967 | 971 | 10.1107/S0108270192011715 | 0.7093 | MolybdenumKα | 0.04 | 0.025 | null | 0.038 | 0.034 | null | null | null | null | 1.25 | 1.25 | null | null | null | has coordinates | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M.
Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol)
Acta Crystallographica Section C
49(5)
(1993)
967-971 | 191,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-02-10 18:21:58 +0200 (Fri, 10 Feb 2017) $
#$Revision: 191977 $
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7,106,557 | 13.1815 | 0.001 | 22.4798 | 0.0017 | 15.222 | 0.0011 | 90 | null | 106.388 | 0.001 | 90 | null | 4,327.3 | 0.6 | 99 | 2 | 99 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C44 H63 Cl Ge N4 Si - | - C44 H63 Cl Ge N4 Si - | - C176 H252 Cl4 Ge4 N16 Si4 - | 4 | 1 | Sankaranarayana Pillai Sarish; Sakya S. Sen; Herbert W. Roesky; Ina Objartel; Dietmar Stalke | Elegant approach to spacer arranged silagermylene and bis(germylene) compounds | Chem.Commun. | 2,011 | 47 | 7206 | 10.1039/c1cc12205c | 0.71073 | MoKα | 0.0453 | 0.0318 | null | null | 0.0673 | 0.0722 | null | null | null | null | null | 1.047 | null | null | has coordinates | Sankaranarayana Pillai Sarish; Sakya S. Sen; Herbert W. Roesky; Ina Objartel; Dietmar Stalke
Elegant approach to spacer arranged silagermylene and bis(germylene) compounds
Chem.Commun.
47
(2011)
7206 | 301,853 | 2025-08-21 | 21:50:04 | #------------------------------------------------------------------------------
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2,001,712 | 7.8205 | 0.0004 | 11.0274 | 0.0004 | 11.7715 | 0.0006 | 105.707 | 0.004 | 106.128 | 0.005 | 102.403 | 0.004 | 891.45 | 0.09 | 293 | null | 293 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | Ferrocenyl(diphenyl)methanol | Ferrocenyl(diphenyl)methanol | - C23 H20 Fe O - | - C23 H20 Fe O - | - C46 H40 Fe2 O2 - | 2 | 1 | LI1034 | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M. | Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 967 | 971 | 10.1107/S0108270192011715 | 0.7093 | MolybdenumKα | 0.039 | 0.03 | null | 0.05 | 0.049 | null | null | null | null | 1.46 | 1.46 | null | null | null | has coordinates | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M.
Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol)
Acta Crystallographica Section C
49(5)
(1993)
967-971 | 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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2,001,713 | 13.2841 | 0.0006 | 23.2856 | 0.0012 | 18.8106 | 0.0008 | 90 | null | 105.482 | 0.004 | 90 | null | 5,607.5 | 0.5 | 293 | null | 293 | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | Ferrocene-1,1'-diylbis(diphenylmethanol) | Ferrocene-1,1'-diylbis(diphenylmethanol) | - C36 H30 Fe O2 - | - C36 H30 Fe O2 - | - C288 H240 Fe8 O16 - | 8 | 1 | LI1034 | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M. | Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 967 | 971 | 10.1107/S0108270192011715 | 0.7093 | MolybdenumKα | 0.06 | 0.036 | null | 0.055 | 0.049 | null | null | null | null | 1.37 | 1.37 | null | null | null | has coordinates | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M.
Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol)
Acta Crystallographica Section C
49(5)
(1993)
967-971 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,714 | 16.164 | 0.002 | 14.747 | 0.001 | 8.3073 | 0.0006 | 90.86 | 0.07 | 112.82 | 0.06 | 108.74 | 0.08 | 1,706.2 | 1.4 | 294 | null | 294 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | Dimethyl 9-methyl-9,10-dihydro-9,10-ethenoanthracene-11,12- dicarboxylate | - C21 H18 O4 - | - C21 H18 O4 - | - C84 H72 O16 - | 4 | 2 | BR1025 | Pokkuluri, P. R.; Trotter, J. | Structure of dimethyl 9-methyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 971 | 973 | 10.1107/S0108270192012022 | 1.54056 | CopperKα | null | 0.066 | null | null | 0.084 | null | null | null | null | 3 | 3 | null | null | null | has coordinates | Pokkuluri, P. R.; Trotter, J.
Structure of dimethyl 9-methyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate
Acta Crystallographica Section C
49(5)
(1993)
971-973 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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7,106,556 | 9.091 | 0.0003 | 9.918 | 0.0003 | 34.352 | 0.0011 | 90.0897 | 0.0019 | 93.55 | 0.002 | 101.84 | 0.0015 | 3,025.29 | 0.17 | 125 | 2 | 125 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | [Fe12a(C16)(Py)2](125) | - C62 H96 Fe N4 O8 - | - C62 H96 Fe N4 O8 - | - C124 H192 Fe2 N8 O16 - | 2 | 1 | Stephan Schlamp; Birgit Weber; Anil D. Naik; Yann Garcia | Cooperative spin transition in a lipid layer like system | Chem.Commun. | 2,011 | 47 | 7152 | 10.1039/c1cc12162f | 0.71073 | MoKα | 0.1114 | 0.0594 | null | null | 0.126 | 0.1485 | null | null | null | null | null | 1.033 | null | null | has coordinates | Stephan Schlamp; Birgit Weber; Anil D. Naik; Yann Garcia
Cooperative spin transition in a lipid layer like system
Chem.Commun.
47
(2011)
7152 | 301,853 | 2025-08-21 | 21:50:04 | #------------------------------------------------------------------------------
#$Date: 2025-08-22 00:26:11 +0300 (Fri, 22 Aug 2025) $
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2,001,715 | 13.698 | 0.004 | 8.944 | 0.004 | 16.67 | 0.01 | 90 | null | 112.02 | 0.04 | 90 | null | 1,893.3 | 1.6 | 296 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C7 H21 Cl6 N3 Te - | - C7 H21 Cl6 N3 Te - | - C28 H84 Cl24 N12 Te4 - | 4 | 1 | CR1030 | Herrara, C.; Zingaro, R. A.; Meyers, E. A. | Structure of dimethylammonium <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylformamidinium hexachlorotellurate(IV) | Acta Crystallographica Section C | 1,993 | 49 | 5 | 973 | 975 | 10.1107/S010827019201196X | 0.71073 | Mo | null | 0.0766 | null | null | 0.0423 | null | null | null | null | 1.91 | 1.91 | null | null | null | has coordinates | Herrara, C.; Zingaro, R. A.; Meyers, E. A.
Structure of dimethylammonium <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylformamidinium hexachlorotellurate(IV)
Acta Crystallographica Section C
49(5)
(1993)
973-975 | 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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2,001,716 | 7.298 | 0.002 | 12.542 | 0.003 | 7.944 | 0.002 | 90 | null | 116.05 | 0.02 | 90 | null | 653.3 | 0.3 | 296 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C10 H6 Cl2 N2 Te2 - | - C10 H6 Cl2 N2 Te2 - | - C20 H12 Cl4 N4 Te4 - | 2 | 0.5 | CR1041 | Junk, T.; Irgolic, K. J.; Meyers, E. A. | Bis(3-chloro-2-pyridyl) ditelluride | Acta Crystallographica Section C | 1,993 | 49 | 5 | 975 | 976 | 10.1107/S0108270192011983 | 0.71073 | MoKα | null | 0.0351 | null | null | 0.0577 | null | null | null | null | 1.76 | 1.76 | null | null | null | has coordinates | Junk, T.; Irgolic, K. J.; Meyers, E. A.
Bis(3-chloro-2-pyridyl) ditelluride
Acta Crystallographica Section C
49(5)
(1993)
975-976 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,717 | 11.086 | 0.002 | 11.086 | 0.002 | 14.367 | 0.004 | 90 | null | 90 | null | 120 | null | 1,529.1 | 0.6 | null | null | null | null | null | null | null | null | 5 | P 31 2 1 | P 31 2" | null | - C21 H29 Cl N2 O - | - C21 H29 Cl N2 O - | - C63 H87 Cl3 N6 O3 - | 3 | 0.5 | LI1010 | Marsh, R. E. | On the structure of 9-amino-2,7-di-<i>tert</i>-butylacridine | Acta Crystallographica Section C | 1,993 | 49 | 1 | 193 | 10.1107/S0108270192005201 | 1.54178 | CuKα | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Marsh, R. E.
On the structure of 9-amino-2,7-di-<i>tert</i>-butylacridine
Acta Crystallographica Section C
49(1)
(1993)
193 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,718 | 6.104 | 0.001 | 8.933 | 0.003 | 16.062 | 0.003 | 90 | null | 90 | null | 90 | null | 875.8 | 0.4 | 293 | null | null | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | null | - C6 H11 N O5 S - | - C6 H11 N O5 S - | - C24 H44 N4 O20 S4 - | 4 | 1 | HE1003 | Portalone, G.; Cassetta, A.; Pagani Zecchini, G.; Torrini, I. | (3<i>R</i>,5<i>R</i>)-Tetrahydro-2<i>H</i>-1,4-thiazine-3,5-dicarboxylic acid monohydrate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 976 | 978 | 10.1107/S0108270192011181 | 1.54184 | Cu | null | 0.0511 | null | null | 0.069 | null | null | null | null | 0.214 | 0.214 | null | null | null | has coordinates | Portalone, G.; Cassetta, A.; Pagani Zecchini, G.; Torrini, I.
(3<i>R</i>,5<i>R</i>)-Tetrahydro-2<i>H</i>-1,4-thiazine-3,5-dicarboxylic acid monohydrate
Acta Crystallographica Section C
49(5)
(1993)
976-978 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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7,106,555 | 9.9758 | 0.0002 | 10.0579 | 0.0002 | 31.5743 | 0.0007 | 90.3395 | 0.0011 | 97.4097 | 0.0011 | 97.2664 | 0.0012 | 3,115.54 | 0.11 | 250 | 2 | 250 | 2 | null | null | null | null | The complex Fe12a(C16)(MeOH)2 and pyridine were heated to reflux in methanol for six hours. After cooling and H2O diffunding into the solution, black crystals of [Fe12a(C16)(Py)2] were obtained within 50 days. | 5 | P -1 | -P 1 | 2 | [Fe12a(C16)(Py)2](250) | - C62 H96 Fe N4 O8 - | - C62 H96 Fe N4 O8 - | - C124 H192 Fe2 N8 O16 - | 2 | 1 | Stephan Schlamp; Birgit Weber; Anil D. Naik; Yann Garcia | Cooperative spin transition in a lipid layer like system | Chem.Commun. | 2,011 | 47 | 7152 | 10.1039/c1cc12162f | 0.71073 | MoKα | 0.212 | 0.0703 | null | null | 0.1554 | 0.2016 | null | null | null | null | null | 0.993 | null | null | has coordinates,has disorder | Stephan Schlamp; Birgit Weber; Anil D. Naik; Yann Garcia
Cooperative spin transition in a lipid layer like system
Chem.Commun.
47
(2011)
7152 | 301,853 | 2025-08-21 | 21:50:04 | #------------------------------------------------------------------------------
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2,001,719 | 10.745 | 0.005 | 11.435 | 0.005 | 13.003 | 0.006 | 90 | null | 90 | null | 90 | null | 1,597.7 | 1.3 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C19 H21 N O4 - | - C19 H21 N O4 - | - C76 H84 N4 O16 - | 4 | 1 | KA1013 | Ribár, B.; Kapor, A.; Gašić, O.; Kanyó, I.; Engel, P. | Structure of sinoacutine | Acta Crystallographica Section C | 1,993 | 49 | 5 | 978 | 980 | 10.1107/S0108270192011417 | 0.7107 | MoKα | null | 0.057 | null | null | null | null | null | null | null | 0.968 | 0.968 | null | null | null | has coordinates | Ribár, B.; Kapor, A.; Gašić, O.; Kanyó, I.; Engel, P.
Structure of sinoacutine
Acta Crystallographica Section C
49(5)
(1993)
978-980 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,001,720 | 5.0846 | 0.0002 | 27.374 | 0.001 | 7.4008 | 0.0003 | 90 | null | 109.528 | 0.003 | 90 | null | 970.83 | 0.07 | 138 | 2 | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C10 H13 N O3 - | - C10 H13 N O3 - | - C40 H52 N4 O12 - | 4 | 1 | ST1027 | Xiao, G.; van der Helm, D.; Hider, R. C.; Dobbin, P. S. | 3-[1-(Ethylamino)ethylidene]-6-methyl-3<i>H</i>-pyran-2,4-dione | Acta Crystallographica Section C | 1,993 | 49 | 5 | 980 | 982 | 10.1107/S0108270192010928 | 1.54178 | CuKα | null | 0.039 | null | null | 0.059 | null | null | null | null | 2.6 | 2.6 | null | null | null | has coordinates | Xiao, G.; van der Helm, D.; Hider, R. C.; Dobbin, P. S.
3-[1-(Ethylamino)ethylidene]-6-methyl-3<i>H</i>-pyran-2,4-dione
Acta Crystallographica Section C
49(5)
(1993)
980-982 | 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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2,001,721 | 7.521 | 0.001 | 10.872 | 0.002 | 22.901 | 0.003 | 90 | null | 90 | null | 90 | null | 1,872.6 | 0.5 | 295 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C22 H24 N2 O4 - | - C22 H24 N2 O4 - | - C88 H96 N8 O16 - | 4 | 1 | LI1028 | Priya, V.; Shamala, N.; Viswamitra, M. A.; Ravindran, T.; Jeyaraman, R. | Structure of 2,4-bis(4-methoxyphenyl)-3-nitroso-3-azabicyclo[3.3.1]nonan-9-one | Acta Crystallographica Section C | 1,993 | 49 | 5 | 983 | 985 | 10.1107/S0108270192011375 | 1.5418 | CuKα | null | 0.059 | null | null | 0.05 | null | null | null | null | 1.87 | 1.87 | null | null | null | has coordinates | Priya, V.; Shamala, N.; Viswamitra, M. A.; Ravindran, T.; Jeyaraman, R.
Structure of 2,4-bis(4-methoxyphenyl)-3-nitroso-3-azabicyclo[3.3.1]nonan-9-one
Acta Crystallographica Section C
49(5)
(1993)
983-985 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
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2,001,722 | 7.742 | 0.002 | 8.886 | 0.002 | 13.101 | 0.003 | 97.39 | 0.02 | 94.35 | 0.02 | 91.42 | 0.02 | 890.7 | 0.4 | 105 | null | 105 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | Muscarine picrate | (±)-(2S,4R,5S)-tetrahydro-4-hydroxy-N,N,N,5-tetramethyl-2-furanaminium picrate | - C15 H22 N4 O9 - | - C15 H22 N4 O9 - | - C30 H44 N8 O18 - | 2 | 1 | AB1045 | Frydenvang, K.; Jensen, B. | Structures of muscarine picrate and muscarine tetraphenylborate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 985 | 990 | 10.1107/S0108270192012198 | 0.71073 | MoKα | null | 0.033 | null | null | 0.042 | null | null | null | null | 1.484 | 1.484 | null | null | null | has coordinates | Frydenvang, K.; Jensen, B.
Structures of muscarine picrate and muscarine tetraphenylborate
Acta Crystallographica Section C
49(5)
(1993)
985-990 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,001,723 | 9.936 | 0.002 | 30.21 | 0.005 | 9.771 | 0.001 | 90 | null | 111.34 | 0.01 | 90 | null | 2,731.8 | 0.8 | 105 | null | 105 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Muscarine tetraphenylborate | (±)-(2S,4R,5S)-tetrahydro-4-hydroxy-N,N,N,5-tetramethyl-2-furanaminium tetraphenylborate | - C33 H40 B N O2 - | - C34 B N O2 - | - C136 B4 N4 O8 - | 4 | 1 | AB1045 | Frydenvang, K.; Jensen, B. | Structures of muscarine picrate and muscarine tetraphenylborate | Acta Crystallographica Section C | 1,993 | 49 | 5 | 985 | 990 | 10.1107/S0108270192012198 | 0.71073 | MoKα | null | 0.13 | null | null | 0.127 | null | null | null | null | 2.885 | 2.885 | null | null | null | has coordinates | Frydenvang, K.; Jensen, B.
Structures of muscarine picrate and muscarine tetraphenylborate
Acta Crystallographica Section C
49(5)
(1993)
985-990 | 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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7,106,554 | 8.1916 | 0.001 | 12.7099 | 0.0016 | 16.097 | 0.002 | 90 | null | 97.767 | 0.002 | 90 | null | 1,660.6 | 0.4 | 90 | null | 90 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Ethyl 2-(6,6-bis(trifluoromethylsulfonyl)cyclohex-2-enyl)acetate | - C12 H14 F6 O6 S2 - | - C12 H14 F6 O6 S2 - | - C48 H56 F24 O24 S8 - | 4 | 1 | Hikaru Yanai; Masaya Fujita; Takeo Taguchi | A regioselective synthesis of poly-substituted aryl triflones through self-promoting three component reaction | Chem.Commun. | 2,011 | 47 | 7245 | 10.1039/c1cc12093j | 0.71073 | MoKα | 0.0385 | 0.0317 | null | null | 0.0757 | 0.0798 | null | null | null | null | null | 1 | null | null | has coordinates | Hikaru Yanai; Masaya Fujita; Takeo Taguchi
A regioselective synthesis of poly-substituted aryl triflones through self-promoting three component reaction
Chem.Commun.
47
(2011)
7245 | 301,853 | 2025-08-21 | 21:50:04 | #------------------------------------------------------------------------------
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2,001,724 | 8.054 | 0.003 | 16.013 | 0.01 | 7.48 | 0.003 | 90 | null | 111.28 | 0.03 | 90 | null | 898.9 | 0.8 | 293 | 2 | null | null | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | null | - C7 H2 Br2 O4 - | - C7 H2 Br2 O4 - | - C28 H8 Br8 O16 - | 4 | 1 | MU1003 | Kožíšek, J.; Dvorský, A.; Végh, D.; Jakubcová, M.; Ječný, J. | Structure of 4,9-dibromo-1,6-dioxaspiro[4.4]nona-3,8-diene-2,7-dione, C~7~H~2~Br~2~O~4~ | Acta Crystallographica Section C | 1,993 | 49 | 5 | 990 | 992 | 10.1107/S0108270192011454 | 1.54178 | CuKα | null | 0.0525 | null | null | 0.0623 | null | null | null | null | 2.3 | 2.3 | null | null | null | has coordinates | Kožíšek, J.; Dvorský, A.; Végh, D.; Jakubcová, M.; Ječný, J.
Structure of 4,9-dibromo-1,6-dioxaspiro[4.4]nona-3,8-diene-2,7-dione, C~7~H~2~Br~2~O~4~
Acta Crystallographica Section C
49(5)
(1993)
990-992 | 301,791 | 2025-08-18 | 23:15:00 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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