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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,010,961 | 12.513 | 0.002 | 14.613 | 0.002 | 12.569 | 0.002 | 90 | null | 109.34 | 0.01 | 90 | null | 2,168.6 | 0.6 | 298 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C18 H26 Cl2 Cu N4 O4 - | - C18 H26 Cl2 Cu N4 O4 - | - C72 H104 Cl8 Cu4 N16 O16 - | 4 | 1 | QA0280 | Kani, Yoshiyuki; Ohba, Shigeru; Kunita, Mami; Nishida, Yuzo | Chloro[<i>N</i>',<i>N</i>'-diethyl-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl)ethylenediamine-κ^4^<i>N</i>]copper(II) perchlorate | Acta Crystallographica Section C | 2,000 | 56 | 5 | e198 | e198 | 10.1107/S010827010000559X | 0.71073 | MoKα | null | 0.064 | null | null | null | 0.161 | null | null | null | null | null | 1.51 | null | null | has coordinates,has Fobs | Kani, Yoshiyuki; Ohba, Shigeru; Kunita, Mami; Nishida, Yuzo
Chloro[<i>N</i>',<i>N</i>'-diethyl-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl)ethylenediamine-κ^4^<i>N</i>]copper(II) perchlorate
Acta Crystallographica Section C
56(5)
(2000)
e198-e198 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,010,962 | 18.06 | 0.003 | 23.477 | 0.003 | 5.736 | 0.002 | 90 | null | 90 | null | 90 | null | 2,432 | 1 | 296 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | - C26 H34 O6 - | - C26 H34 O6 - | - C104 H136 O24 - | 4 | 1 | QA0281 | Kani, Yoshiyuki; Ohba, Shigeru; Amano, Seiji; Ogawa, Noriko; Ohtsuka, Masami; Chida, Noritaka | (1<i>R</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>)-2-[(2<i>R</i>,3<i>S</i>)-2,3-Dimethyloxiran-2-yl]-3,4-bis(4-methoxybenzyloxy)cyclohexanol | Acta Crystallographica Section C | 2,000 | 56 | 5 | e222 | e222 | 10.1107/S0108270100005606 | 0.71073 | MoKα | null | 0.073 | null | null | null | 0.221 | null | null | null | null | null | 1.92 | null | null | has coordinates,has Fobs | Kani, Yoshiyuki; Ohba, Shigeru; Amano, Seiji; Ogawa, Noriko; Ohtsuka, Masami; Chida, Noritaka
(1<i>R</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>)-2-[(2<i>R</i>,3<i>S</i>)-2,3-Dimethyloxiran-2-yl]-3,4-bis(4-methoxybenzyloxy)cyclohexanol
Acta Crystallographica Section C
56(5)
(2000)
e222-e222 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,010,963 | 14.381 | 0.002 | 14.381 | 0.002 | 12.265 | 0.002 | 90 | null | 90 | null | 90 | null | 2,536.6 | 0.6 | 296 | null | null | null | null | null | null | null | 4 | P 43 | P 4cw | 78 | - C23 H29 N O11 - | - C23 H29 N O11 - | - C92 H116 N4 O44 - | 4 | 1 | QA0282 | Kani, Yoshiyuki; Ohba, Shigeru; Oishi, Takeshi; Ando, Koji; Inomiya, Kenjin; Chida, Noritaka | (2<i>S</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,6<i>S</i>)-6-Benzyloxymethyl-4-(methoxymethyloxy)-9-oxo-8-oxa-1-azabicyclo[4.3.0]nonane-2,3,5-triyl triacetate | Acta Crystallographica Section C | 2,000 | 56 | 5 | e223 | e223 | 10.1107/S0108270100005618 | 0.71073 | MoKα | null | 0.047 | null | null | null | 0.116 | null | null | null | null | null | 1.19 | null | null | has coordinates,has Fobs | Kani, Yoshiyuki; Ohba, Shigeru; Oishi, Takeshi; Ando, Koji; Inomiya, Kenjin; Chida, Noritaka
(2<i>S</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,6<i>S</i>)-6-Benzyloxymethyl-4-(methoxymethyloxy)-9-oxo-8-oxa-1-azabicyclo[4.3.0]nonane-2,3,5-triyl triacetate
Acta Crystallographica Section C
56(5)
(2000)
e223-e223 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010963.cif $
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2,010,964 | 8.0114 | 0.0004 | 9.8149 | 0.0007 | 10.2505 | 0.0008 | 107.919 | 0.002 | 106.039 | 0.004 | 91.831 | 0.004 | 731 | 0.09 | 291 | 1 | 291 | 1 | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C16 H26 O2 - | - C16 H26 O2 - | - C32 H52 O4 - | 2 | 1 | QB0191 | Hollmann, Christoph; Schürmann, Markus; Preut, Hans; Eilbracht, Peter | (1<i>R</i>*,11<i>R</i>*)-Bicyclo[9.4.1]hexadecane-12,16-dione | Acta Crystallographica Section C | 2,000 | 56 | 5 | e215 | e215 | 10.1107/S010827010000528X | 0.71073 | MoKα | 0.089 | 0.04 | null | null | null | 0.098 | null | null | null | null | null | 0.922 | null | null | has coordinates,has Fobs | Hollmann, Christoph; Schürmann, Markus; Preut, Hans; Eilbracht, Peter
(1<i>R</i>*,11<i>R</i>*)-Bicyclo[9.4.1]hexadecane-12,16-dione
Acta Crystallographica Section C
56(5)
(2000)
e215-e215 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,010,965 | 10.675 | 0.002 | 11.083 | 0.002 | 15.195 | 0.003 | 90 | null | 108.19 | 0.03 | 90 | null | 1,707.9 | 0.6 | 293 | 2 | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | Bis(acetonylpyridine) pyridinium hexaiodo-bismuth(III) | - C21 H26 Bi I6 N3 O2 - | - C22.18 H26 Bi I6 N2 O2 - | - C44.36 H52 Bi2 I12 N4 O4 - | 2 | 0.5 | QB0197 | Peng, Ying; Lu, Shaofang; Wu, Daxu; Wu, Qiangjin; Huang, Jianquan | Bis(1-acetonylpyridinium) pyridinium hexaiodobismuth(III) | Acta Crystallographica Section C | 2,000 | 56 | 5 | e183 | e184 | 10.1107/S0108270100005230 | 0.71069 | MoKα | null | 0.036 | null | null | null | 0.091 | null | null | null | null | null | 1.039 | null | null | has coordinates,has Fobs | Peng, Ying; Lu, Shaofang; Wu, Daxu; Wu, Qiangjin; Huang, Jianquan
Bis(1-acetonylpyridinium) pyridinium hexaiodobismuth(III)
Acta Crystallographica Section C
56(5)
(2000)
e183-e184 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,010,966 | 7.201 | 0.002 | 10.348 | 0.002 | 7.19 | 0.002 | 95.59 | 0.02 | 92.95 | 0.02 | 98.47 | 0.02 | 526.2 | 0.2 | 303 | null | 303 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C8 H9 Cl2 N O4 - | - C8 H9 Cl2 N O4 - | - C16 H18 Cl4 N2 O8 - | 2 | 1 | QB0198 | Ishida, Hiroyuki; Kashino, Setsuo | Ethylammonium and diethylammonium salts of chloranilic acid | Acta Crystallographica Section C | 2,000 | 56 | 5 | e202 | e204 | 10.1107/S0108270100004480 | 0.71073 | MoKα | 0.058 | 0.042 | null | 0.058 | null | 0.05 | null | null | 1.29 | null | null | 1.29 | null | null | has coordinates | Ishida, Hiroyuki; Kashino, Setsuo
Ethylammonium and diethylammonium salts of chloranilic acid
Acta Crystallographica Section C
56(5)
(2000)
e202-e204 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,967 | 9.159 | 0.003 | 9.617 | 0.002 | 8.979 | 0.003 | 108.17 | 0.02 | 111.27 | 0.03 | 103.78 | 0.02 | 642.8 | 0.4 | 302 | null | 302 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C10 H13 Cl2 N O4 - | - C10 H13 Cl2 N O4 - | - C20 H26 Cl4 N2 O8 - | 2 | 1 | QB0198 | Ishida, Hiroyuki; Kashino, Setsuo | Ethylammonium and diethylammonium salts of chloranilic acid | Acta Crystallographica Section C | 2,000 | 56 | 5 | e202 | e204 | 10.1107/S0108270100004480 | 0.71073 | MoKα | 0.062 | 0.053 | null | 0.099 | null | 0.091 | null | null | 1.64 | null | null | 1.64 | null | null | has coordinates | Ishida, Hiroyuki; Kashino, Setsuo
Ethylammonium and diethylammonium salts of chloranilic acid
Acta Crystallographica Section C
56(5)
(2000)
e202-e204 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,968 | 7.827 | 0.0004 | 12.7936 | 0.0008 | 17.3523 | 0.0012 | 90 | null | 90 | null | 90 | null | 1,737.58 | 0.18 | 173 | 2 | 173 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | 2(S)-amino-3-(1H-imidazol-4(5)-yl)propyl cyclohexylmethyl ether dihydrochloride | - C13 H25 Cl2 N3 O - | - C13 H25 Cl2 N3 O - | - C52 H100 Cl8 N12 O4 - | 4 | 1 | QB0202 | Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka | 2(<i>S</i>)-Amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl cyclohexylmethyl ether dihydrochloride and 2(<i>S</i>)-amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl 4-bromobenzyl ether dihydrochloride | Acta Crystallographica Section C | 2,000 | 56 | 5 | e216 | e217 | 10.1107/S0108270100005291 | 0.71073 | MoKα | 0.094 | 0.046 | null | null | null | 0.084 | null | null | null | null | null | 1.009 | null | null | has coordinates,has Fobs | Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka
2(<i>S</i>)-Amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl cyclohexylmethyl ether dihydrochloride and 2(<i>S</i>)-amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl 4-bromobenzyl ether dihydrochloride
Acta Crystallographica Section... | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010968.cif $
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2,010,969 | 7.553 | 0.0002 | 12.9964 | 0.0006 | 17.78 | 0.0009 | 90 | null | 90 | null | 90 | null | 1,745.32 | 0.13 | 173 | 2 | 173 | 2 | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | 19 | 2(S)-amino-3-(1H-imidazol-4(5)-yl)propyl 4-bromobenzyl ether dihydrochloride | - C13 H18 Br Cl2 N3 O - | - C13 H18 Br Cl2 N3 O - | - C52 H72 Br4 Cl8 N12 O4 - | 4 | 1 | QB0202 | Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka | 2(<i>S</i>)-Amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl cyclohexylmethyl ether dihydrochloride and 2(<i>S</i>)-amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl 4-bromobenzyl ether dihydrochloride | Acta Crystallographica Section C | 2,000 | 56 | 5 | e216 | e217 | 10.1107/S0108270100005291 | 0.71073 | MoKα | 0.088 | 0.047 | null | null | null | 0.09 | null | null | null | null | null | 1.037 | null | null | has coordinates,has Fobs | Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka
2(<i>S</i>)-Amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl cyclohexylmethyl ether dihydrochloride and 2(<i>S</i>)-amino-3-[1<i>H</i>-imidazol-4(5)-yl]propyl 4-bromobenzyl ether dihydrochloride
Acta Crystallographica Section... | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010969.cif $
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2,010,970 | 7.6548 | 0.0015 | 10.436 | 0.002 | 17.543 | 0.004 | 90 | null | 91.34 | 0.03 | 90 | null | 1,401 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | N2-(4-Methoxyphenyl)-3-(2-pyrrolidinyliden)-1-chloro-1,1- -difluoro-2-propan imine | - C14 H15 Cl F2 N2 O - | - C14 H15 Cl F2 N2 O - | - C56 H60 Cl4 F8 N8 O4 - | 4 | 1 | QB0204 | Fustero, Santos; García de la Torre, Marta; Ramírez de Arellano, M. Carmen | 1-Chloro-1,1-difluoro-<i>N</i>-(4-methoxyphenyl)-3-(pyrrolidin-2-ylidene)propan-2-imine | Acta Crystallographica Section C | 2,000 | 56 | 5 | e213 | e214 | 10.1107/S0108270100005217 | 0.71073 | MoKα | 0.094 | 0.07 | null | null | null | 0.208 | null | null | null | null | null | 1.038 | null | null | has coordinates,has Fobs | Fustero, Santos; García de la Torre, Marta; Ramírez de Arellano, M. Carmen
1-Chloro-1,1-difluoro-<i>N</i>-(4-methoxyphenyl)-3-(pyrrolidin-2-ylidene)propan-2-imine
Acta Crystallographica Section C
56(5)
(2000)
e213-e214 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010970.cif $
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2,010,971 | 10.3829 | 0.0007 | 14.0871 | 0.0012 | 14.9994 | 0.0014 | 90 | null | 102.931 | 0.009 | 90 | null | 2,138.3 | 0.3 | 295 | null | 295 | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - Cr H48 I Mo6 Na2 O48 - | - Cr I Mo6 Na2 O48 - | - Cr2 I2 Mo12 Na4 O96 - | 2 | 0.5 | QB0206 | Rosu, Cristina; Weakley, Timothy J. R. | Disodium chromium(III) hexamolybdoiodate(VII) 24-hydrate, Na~2~Cr[IMo~6~O~24~]·24H~2~O | Acta Crystallographica Section C | 2,000 | 56 | 5 | e170 | e171 | 10.1107/S0108270100005229 | 0.71073 | MoKα | 0.046 | 0.034 | null | 0.095 | null | 0.05 | null | null | 1.86 | null | null | 1.86 | null | null | has coordinates,has Fobs | Rosu, Cristina; Weakley, Timothy J. R.
Disodium chromium(III) hexamolybdoiodate(VII) 24-hydrate, Na~2~Cr[IMo~6~O~24~]·24H~2~O
Acta Crystallographica Section C
56(5)
(2000)
e170-e171 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010971.cif $
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2,010,972 | 9.825 | 0.002 | 10.904 | 0.002 | 16.051 | 0.003 | 90 | null | 101.44 | 0.03 | 90 | null | 1,685.4 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C20 H40 Cu2 N4 Se8 - | - C20 H40 Cu2 N4 Se8 - | - C40 H80 Cu4 N8 Se16 - | 2 | 0.5 | QB0207 | Bao, Mutai; Weng, Jiabao; Su, Weiping; Cao, Rong; Hong, Maochun | Bis[bis(<i>N</i>,<i>N</i>-diethyl-1,1-diselenocarbamato)copper(II)], [Cu(Se~2~CNEt~2~)~2~]~2~ | Acta Crystallographica Section C | 2,000 | 56 | 5 | e185 | e186 | 10.1107/S0108270100005503 | 0.71073 | MoKα | 0.041 | 0.032 | null | null | null | 0.086 | null | null | null | null | null | 1.082 | null | null | has coordinates,has Fobs | Bao, Mutai; Weng, Jiabao; Su, Weiping; Cao, Rong; Hong, Maochun
Bis[bis(<i>N</i>,<i>N</i>-diethyl-1,1-diselenocarbamato)copper(II)], [Cu(Se~2~CNEt~2~)~2~]~2~
Acta Crystallographica Section C
56(5)
(2000)
e185-e186 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,010,973 | 6.719 | 0.001 | 10.029 | 0.002 | 25.615 | 0.005 | 90 | null | 90.65 | 0.03 | 90 | null | 1,726 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | Bis(N,N-diethyl-1,1-diselenocarbamate)selenium | - C10 H20 N2 Se5 - | - C10 H20 N2 Se5 - | - C40 H80 N8 Se20 - | 4 | 1 | QB0208 | Bao, Mutai; Hong, Maochun; Su, Weiping; Cao, Rong | Bis(<i>N</i>,<i>N</i>-diethyl-1,1-diselenocarbamato-<i>Se</i>)selenium, [(Se~2~CNEt~2~)~2~Se] | Acta Crystallographica Section C | 2,000 | 56 | 5 | e219 | e220 | 10.1107/S0108270100005497 | 0.71073 | MoKα | 0.067 | 0.048 | null | null | null | 0.113 | null | null | null | null | null | 0.996 | null | null | has coordinates,has Fobs | Bao, Mutai; Hong, Maochun; Su, Weiping; Cao, Rong
Bis(<i>N</i>,<i>N</i>-diethyl-1,1-diselenocarbamato-<i>Se</i>)selenium, [(Se~2~CNEt~2~)~2~Se]
Acta Crystallographica Section C
56(5)
(2000)
e219-e220 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,974 | 21.093 | 0.002 | 4.6905 | 0.0003 | 9.2544 | 0.0009 | 90 | null | 101.323 | 0.003 | 90 | null | 897.78 | 0.14 | 150 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 c 1 | P -2yc | 7 | Zinc octanoate | poly[zinc(II)-bis(μ-octanoato-O:O')] | - C16 H30 O4 Zn - | - C16 H30 O4 Zn - | - C32 H60 O8 Zn2 - | 2 | 1 | SK1351 | Lacouture, Françoise; Peultier, Jerôme; Francois, Michel; Steinmetz, Jean | Anhydrous polymeric zinc(II) octanoate | Acta Crystallographica Section C | 2,000 | 56 | 5 | 556 | 557 | 10.1107/S0108270100001876 | 0.71073 | MoKα | 0.088 | 0.058 | null | null | null | 0.167 | null | null | null | null | null | 1.002 | null | null | has coordinates | Lacouture, Françoise; Peultier, Jerôme; Francois, Michel; Steinmetz, Jean
Anhydrous polymeric zinc(II) octanoate
Acta Crystallographica Section C
56(5)
(2000)
556-557 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010974.cif $
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2,010,975 | 11.831 | 0.002 | 14.927 | 0.003 | 12.929 | 0.003 | 90 | null | 98.63 | 0.03 | 90 | null | 2,257.4 | 0.8 | 173 | 2 | 173 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C20 H16 Cl2 I2 N4 Si - | - C20 H16 Cl2 I2 N4 Si - | - C80 H64 Cl8 I8 N16 Si4 - | 4 | 1 | SK1363 | Hensen, Karl; Mayr-Stein, Ralf; Rühl, Stephan; Bolte, Michael | <i>cis</i>-Bis(2,2'-bipyridyl-<i>N</i>,<i>N</i>')dichlorosilicon diiodide | Acta Crystallographica Section C | 2,000 | 56 | 5 | 607 | 609 | 10.1107/S0108270100001888 | 0.71073 | MoKα | 0.0441 | 0.0289 | null | null | null | 0.0597 | null | null | null | null | null | 1.071 | null | null | has coordinates,has Fobs | Hensen, Karl; Mayr-Stein, Ralf; Rühl, Stephan; Bolte, Michael
<i>cis</i>-Bis(2,2'-bipyridyl-<i>N</i>,<i>N</i>')dichlorosilicon diiodide
Acta Crystallographica Section C
56(5)
(2000)
607-609 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,976 | 15.125 | 0.0004 | 5.6702 | 0.0001 | 22.8781 | 0.0005 | 90 | null | 95.3753 | 0.0013 | 90 | null | 1,953.44 | 0.08 | 291 | 2 | 291 | 2 | null | null | null | null | 3 | C 1 2 1 | C 2y | 5 | asperuloside monohydrate | [2aS-(2aα,4aα,5α,7bα)]-5-(β-D-glucopyranosyloxy)-1-oxo-2a,4a,5,7b- tetrahydro-1H-2,6-dioxacyclopenta[cd]inden-4-ylmethyl acetate monohydrate | - C18 H24 O12 - | - C18 H24 O12 - | - C72 H96 O48 - | 4 | 1 | SK1376 | Linden, Anthony; Çalis, Ihsan; Neuburger, Markus; Sticher, Otto | Asperuloside monohydrate | Acta Crystallographica Section C | 2,000 | 56 | 5 | 616 | 618 | 10.1107/S0108270100003292 | 0.71073 | MoKα | 0.061 | 0.041 | null | null | null | 0.101 | null | null | null | null | null | 1.028 | null | null | has coordinates,has Fobs | Linden, Anthony; Çalis, Ihsan; Neuburger, Markus; Sticher, Otto
Asperuloside monohydrate
Acta Crystallographica Section C
56(5)
(2000)
616-618 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,977 | 13.378 | 0.002 | 13.378 | 0.002 | 18.803 | 0.006 | 90 | null | 90 | null | 90 | null | 3,365.2 | 1.3 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 43 21 2 | P 4nw 2abw | 96 | - C20 H24 O2 - | - C20 H24 O2 - | - C160 H192 O16 - | 8 | 1 | SX1081 | Do Valle, N. T.; De Simone, C. A.; Pereira, M. A.; Goulart, M. O. F. | [1a(1aα,5β,9aα)]-1,1a,4,5,7,8,9,9a-Octahydro-3-hydroxy-1,1,2,5-tetramethyl-7-methylene-6<i>H</i>-cyclopropa[3,4]cyclohept[1,2-<i>e</i>]inden-6-one | Acta Crystallographica Section C | 2,000 | 56 | 5 | 566 | 567 | 10.1107/S0108270199016108 | 0.71073 | MoKα | 0.0711 | 0.0573 | null | null | null | 0.1249 | null | null | null | null | null | 1.157 | null | null | has coordinates | Do Valle, N. T.; De Simone, C. A.; Pereira, M. A.; Goulart, M. O. F.
[1a(1aα,5β,9aα)]-1,1a,4,5,7,8,9,9a-Octahydro-3-hydroxy-1,1,2,5-tetramethyl-7-methylene-6<i>H</i>-cyclopropa[3,4]cyclohept[1,2-<i>e</i>]inden-6-one
Acta Crystallographica Section C
56(5)
(2000)
566-567 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,978 | 9.502 | 0.001 | 10.286 | 0.001 | 11.289 | 0.001 | 87.76 | 0.01 | 77.48 | 0.01 | 69.85 | 0.01 | 1,010.43 | 0.19 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C10 H24 Mn2 O19 - | - C10 H24 Mn2 O19 - | - C20 H48 Mn4 O38 - | 2 | 1 | TA1268 | Deping Cheng; Yueqing Zheng; Jianli Lin; Duanjun Xu; Yuanzhi Xu | A binuclear manganese(II) complex, decaaqua(μ-1,2,4,5-benzenetetracarboxylato-<i>O</i>^1^:<i>O</i>^4^)dimanganese(II) hydrate | Acta Crystallographica Section C | 2,000 | 56 | 5 | 523 | 524 | 10.1107/S0108270100000342 | 0.71073 | MoKα | 0.0344 | 0.0298 | null | 0.0864 | 0.0829 | null | null | null | 1.029 | 1.06 | 1.06 | null | null | null | has coordinates | Deping Cheng; Yueqing Zheng; Jianli Lin; Duanjun Xu; Yuanzhi Xu
A binuclear manganese(II) complex, decaaqua(μ-1,2,4,5-benzenetetracarboxylato-<i>O</i>^1^:<i>O</i>^4^)dimanganese(II) hydrate
Acta Crystallographica Section C
56(5)
(2000)
523-524 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010978.cif $
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2,010,979 | 15.169 | 0.01 | 25.197 | 0.008 | 11.638 | 0.006 | 90 | null | 90 | null | 90 | null | 4,448 | 4 | 296.2 | null | null | null | null | null | null | null | 8 | P 21 21 21 | P 2ac 2ab | 19 | trans-(4-Amino-2,2,6,6-tetramethylpiperidine-N^4^)bis(pentane-2,4-dionato-O,O') (triphenylphosphine-P)cobalt(III) hexafluorophosphate dichloromethane solvate | - C38 H51 Cl2 Co F6 N2 O4 P2 - | - C38 H51 Cl2 Co F6 N2 O4 P2 - | - C152 H204 Cl8 Co4 F24 N8 O16 P8 - | 4 | 1 | TA1277 | Suzuki, Takayoshi; Ogita, Masahiro; Kaizaki, Sumio | <i>trans</i>-(4-Amino-2,2,6,6-tetramethylpiperidine-<i>N</i>^4^)bis(pentane-2,4-dionato-<i>O</i>,<i>O</i>')(triphenylphosphine-<i>P</i>)cobalt(III) hexafluorophosphate dichloromethane solvate | Acta Crystallographica Section C | 2,000 | 56 | 5 | 532 | 533 | 10.1107/S010827010000113X | 0.7107 | MoKα | null | 0.051 | null | null | null | 0.193 | null | null | null | null | null | 0.969 | null | null | has coordinates,has Fobs | Suzuki, Takayoshi; Ogita, Masahiro; Kaizaki, Sumio
<i>trans</i>-(4-Amino-2,2,6,6-tetramethylpiperidine-<i>N</i>^4^)bis(pentane-2,4-dionato-<i>O</i>,<i>O</i>')(triphenylphosphine-<i>P</i>)cobalt(III) hexafluorophosphate dichloromethane solvate
Acta Crystallographica Section C
56(5)
(2000)
532-533 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010979.cif $
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2,010,980 | 12.2683 | 0.001 | 15.0622 | 0.0017 | 18.2824 | 0.0017 | 81.818 | 0.009 | 71.05 | 0.007 | 85.001 | 0.009 | 3,159.7 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | dipotassium di-μ-oxo-bis[aqua(oxalato-O^1^,O^2^)oxomolybdenum(III)] trihydrate | - C4 H10 K2 Mo2 O17 - | - C4 H10 K2 Mo2 O17 - | - C32 H80 K16 Mo16 O136 - | 8 | 4 | AV1030 | Strukan, Neven; Cindrić, Marina; Kamenar, Boris | K~2~[Mo~2~O~4~(C~2~O~4~)~2~(H~2~O)~2~]·3H~2~O | Acta Crystallographica Section C | 2,000 | 56 | 6 | 639 | 641 | 10.1107/S0108270100002547 | 0.71069 | MoKα | 0.165 | 0.049 | null | 0.142 | null | 0.106 | null | null | 0.934 | null | null | 0.934 | null | null | has coordinates,has Fobs | Strukan, Neven; Cindrić, Marina; Kamenar, Boris
K~2~[Mo~2~O~4~(C~2~O~4~)~2~(H~2~O)~2~]·3H~2~O
Acta Crystallographica Section C
56(6)
(2000)
639-641 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010980.cif $
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2,010,981 | 13.58 | 0.005 | 9.488 | 0.002 | 20.266 | 0.007 | 90 | null | 99.73 | 0.03 | 90 | null | 2,573.7 | 1.4 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | N-nitrosomelatonin | - C13 H15 N3 O3 - | - C13 H15 N3 O3 - | - C104 H120 N24 O24 - | 8 | 1 | BK1515 | Turjanski, Adrián; Chaia, Zulema Débora; Doctorovich, Fabio; Estrin, Dario; Rosenstein, Ruth; Piro, Oscar E. | <i>N</i>-Nitrosomelatonin | Acta Crystallographica Section C | 2,000 | 56 | 6 | 682 | 683 | 10.1107/S010827010000456X | 0.71073 | MoKα | 0.082 | 0.042 | null | 0.151 | null | 0.109 | null | null | 1.08 | null | null | 1.01 | null | null | has coordinates | Turjanski, Adrián; Chaia, Zulema Débora; Doctorovich, Fabio; Estrin, Dario; Rosenstein, Ruth; Piro, Oscar E.
<i>N</i>-Nitrosomelatonin
Acta Crystallographica Section C
56(6)
(2000)
682-683 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,010,982 | 6.6363 | 0.0013 | 8.1836 | 0.0016 | 10.468 | 0.002 | 70.68 | 0.03 | 88.01 | 0.03 | 80.77 | 0.03 | 529.4 | 0.2 | 153 | 2 | 153 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | 2-(1,3-dithian-2-yl)benzaldehyde | - C11 H12 O S2 - | - C11 H12 O S2 - | - C22 H24 O2 S4 - | 2 | 1 | BK1516 | Jene, Paul G.; Ibers, James A. | 2-(1,3-Dithian-2-yl)benzaldehyde and <i>N</i>-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide | Acta Crystallographica Section C | 2,000 | 56 | 6 | 705 | 707 | 10.1107/S010827010000353X | 0.71073 | MoKα | 0.041 | 0.039 | null | null | null | 0.112 | null | null | null | null | null | 2.07 | null | null | has coordinates,has Fobs | Jene, Paul G.; Ibers, James A.
2-(1,3-Dithian-2-yl)benzaldehyde and <i>N</i>-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide
Acta Crystallographica Section C
56(6)
(2000)
705-707 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010982.cif $
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2,010,983 | 6.02 | 0.0004 | 15.0289 | 0.0011 | 18.966 | 0.0013 | 90 | null | 94.841 | 0.001 | 90 | null | 1,709.8 | 0.2 | 153 | 2 | 153 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | N-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide | - C20 H19 N O5 - | - C20 H19 N O5 - | - C80 H76 N4 O20 - | 4 | 1 | BK1516 | Jene, Paul G.; Ibers, James A. | 2-(1,3-Dithian-2-yl)benzaldehyde and <i>N</i>-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide | Acta Crystallographica Section C | 2,000 | 56 | 6 | 705 | 707 | 10.1107/S010827010000353X | 0.71073 | MoKα | 0.096 | 0.05 | null | null | null | 0.096 | null | null | null | null | null | 1.04 | null | null | has coordinates,has Fobs | Jene, Paul G.; Ibers, James A.
2-(1,3-Dithian-2-yl)benzaldehyde and <i>N</i>-{2-[2-(1,3-dioxan-2-yl)phenoxy]ethyl}phthalimide
Acta Crystallographica Section C
56(6)
(2000)
705-707 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010983.cif $
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2,010,984 | 10.97 | 0.002 | 8.986 | 0.002 | 20.881 | 0.004 | 90 | null | 103.66 | 0.03 | 90 | null | 2,000.2 | 0.7 | 150 | 2 | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | - C11 H8 N4 S - | - C11 H8 N4 S - | - C88 H64 N32 S8 - | 8 | 1 | BM1405 | Coles, Simon J.; Douheret, David; Hursthouse, Michael B.; Kilburn, Jeremy D. | 2-(2-Pyridylimino)-2<i>H</i>-1,2,4-thiadiazolo[2,3-<i>a</i>]pyridine | Acta Crystallographica Section C | 2,000 | 56 | 6 | 687 | 688 | 10.1107/S0108270100003152 | 0.71073 | MoKα | null | 0.0274 | null | null | null | 0.0645 | null | null | null | null | null | 1.162 | null | null | has coordinates,has Fobs | Coles, Simon J.; Douheret, David; Hursthouse, Michael B.; Kilburn, Jeremy D.
2-(2-Pyridylimino)-2<i>H</i>-1,2,4-thiadiazolo[2,3-<i>a</i>]pyridine
Acta Crystallographica Section C
56(6)
(2000)
687-688 | 201,957 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:48:21 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201957 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010984.cif $
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2,010,985 | 6.297 | 0.004 | 4.951 | 0.003 | 12.751 | 0.006 | 90 | null | 91.65 | 0.06 | 90 | null | 397.4 | 0.4 | 296 | 2 | 296 | 2 | null | null | null | null | 5 | P 1 2/c 1 | -P 2yc | 13 | Lithium Rubidium Gallium Borate | - B3 Ga2 Li2 O9 Rb - | - B3 Ga2 Li2 O9 Rb - | - B6 Ga4 Li4 O18 Rb2 - | 2 | 0.5 | BR1279 | Judith L. Kissick; Douglas A. Keszler | RbLi~2~Ga~2~(BO~3~)~3~ | Acta Crystallographica Section C | 2,000 | 56 | 6 | 631 | 632 | 10.1107/S0108270100004078 | 0.71069 | MoKα | 0.0414 | 0.026 | null | null | null | 0.0724 | null | null | null | null | null | 1.05 | null | null | has coordinates,has Fobs | Judith L. Kissick; Douglas A. Keszler
RbLi~2~Ga~2~(BO~3~)~3~
Acta Crystallographica Section C
56(6)
(2000)
631-632 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010985.cif $
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2,010,986 | 16.05 | 0.003 | 3.9375 | 0.0008 | 7.0309 | 0.0014 | 90 | null | 90 | null | 90 | null | 444.33 | 0.15 | 153 | 2 | 153 | 2 | null | null | null | null | 3 | P n m a | -P 2ac 2n | 62 | - Gd2 O Se2 - | - Gd2 O Se2 - | - Gd8 O4 Se8 - | 4 | 0.5 | BR1282 | Tougait, Olivier; Ibers, James A. | Gd~2~OSe~2~ | Acta Crystallographica Section C | 2,000 | 56 | 6 | 623 | 624 | 10.1107/S0108270100003024 | 0.71073 | MoKα | 0.0256 | 0.0235 | null | null | null | 0.0588 | null | null | null | null | null | 1.101 | null | null | has coordinates,has Fobs | Tougait, Olivier; Ibers, James A.
Gd~2~OSe~2~
Acta Crystallographica Section C
56(6)
(2000)
623-624 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010986.cif $
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2,010,987 | 7.0725 | 0.0005 | 8.4187 | 0.0007 | 14.2273 | 0.0011 | 90 | null | 90 | null | 90 | null | 847.11 | 0.11 | 300 | null | 300 | null | null | null | null | null | 3 | P b n m | -P 2c 2ab | 62 | - La2 O9 Se3 - | - La2 O9 Se3 - | - La8 O36 Se12 - | 4 | 0.5 | BR1284 | Harrison, William T. A. | Lanthanum selenite, La~2~(SeO~3~)~3~ | Acta Crystallographica Section C | 2,000 | 56 | 6 | 627 | 628 | 10.1107/S0108270100003164 | 0.71073 | MoKα | null | 0.026 | null | null | null | 0.029 | null | null | null | null | null | 1.08 | null | null | has coordinates | Harrison, William T. A.
Lanthanum selenite, La~2~(SeO~3~)~3~
Acta Crystallographica Section C
56(6)
(2000)
627-628 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010987.cif $
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2,010,988 | 7.7247 | 0.0006 | 10.2237 | 0.0007 | 8.3429 | 0.0006 | 90 | null | 104.788 | 0.001 | 90 | null | 637.06 | 0.08 | 153 | 2 | 153 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | cesium titanium pyrophosphate | - Cs O7 P2 Ti - | - Cs O7 P2 Ti - | - Cs4 O28 P8 Ti4 - | 4 | 1 | BR1285 | Huang, Fu Qiang; Ibers, James A. | CsTiP~2~O~7~ | Acta Crystallographica Section C | 2,000 | 56 | 6 | 625 | 626 | 10.1107/S0108270100003036 | 0.71073 | MoKα | 0.0235 | 0.0234 | null | null | null | 0.0682 | null | null | null | null | null | 1.417 | null | null | has coordinates,has Fobs | Huang, Fu Qiang; Ibers, James A.
CsTiP~2~O~7~
Acta Crystallographica Section C
56(6)
(2000)
625-626 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010988.cif $
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2,010,989 | 13.9497 | 0.0013 | 14.7055 | 0.0015 | 14.049 | 0.002 | 90 | null | 109.43 | 0.008 | 90 | null | 2,717.8 | 0.6 | 163 | null | 163 | null | null | null | null | null | 7 | P 1 21/n 1 | -P 2yn | 14 | (η^6^-hexamethylbenzene)bis(trifluoromethanesulfonato-O) (2,4,6-trimethylaniline-N)ruthenium(II) | - C23 H31 F6 N O6 Ru S2 - | - C23 H31 F6 N O6 Ru S2 - | - C92 H124 F24 N4 O24 Ru4 S8 - | 4 | 1 | DA1103 | Feher, Frank J.; Baldwin, Richard K.; Ziller, Joseph W. | (η^6^-Hexamethylbenzene)(mesidine)ditriflatoruthenium(II) | Acta Crystallographica Section C | 2,000 | 56 | 6 | 633 | 634 | 10.1107/S0108270100001001 | 0.71073 | MoKα | 0.045 | 0.03 | null | null | null | 0.07 | null | null | null | null | null | 1.038 | null | null | has coordinates,has Fobs | Feher, Frank J.; Baldwin, Richard K.; Ziller, Joseph W.
(η^6^-Hexamethylbenzene)(mesidine)ditriflatoruthenium(II)
Acta Crystallographica Section C
56(6)
(2000)
633-634 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010989.cif $
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2,010,990 | 5.1886 | 0.0006 | 7.8583 | 0.001 | 8.6621 | 0.001 | 90 | null | 104.977 | 0.008 | 90 | null | 341.19 | 0.07 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | Polymeric bis(glycolato)cobalt(II) | - C4 H6 Co O6 - | - C4 H6 Co O6 - | - C8 H12 Co2 O12 - | 2 | 0.5 | DA1106 | Medina, Gerardo; Gasque, Laura; Bernès, Sylvain | Polymeric bis(glycolato)cobalt(II) | Acta Crystallographica Section C | 2,000 | 56 | 6 | 637 | 638 | 10.1107/S010827010000161X | 0.71073 | MoKα | 0.024 | 0.02 | null | null | null | 0.053 | null | null | null | null | null | 1.096 | null | null | has coordinates,has Fobs | Medina, Gerardo; Gasque, Laura; Bernès, Sylvain
Polymeric bis(glycolato)cobalt(II)
Acta Crystallographica Section C
56(6)
(2000)
637-638 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010990.cif $
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2,010,991 | 8.3856 | 0.0004 | 9.727 | 0.0004 | 11.186 | 0.0005 | 69.274 | 0.003 | 68.037 | 0.003 | 70.933 | 0.003 | 771.31 | 0.06 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | Ethyl E-2-Cyano-3-(8-dimethylaminonaphth-1-yl)propenoate | - C18 H18 N2 O2 - | - C18 H18 N2 O2 - | - C36 H36 N4 O4 - | 2 | 1 | FG1575 | Paul C. Bell; Marie Drameh; Nicola Hanley; John D. Wallis | Interaction between a dimethylamino group and an electron-deficient alkene in ethyl (<i>E</i>)-2-cyano-3-(8-dimethylamino-1-naphthyl)propenoate | Acta Crystallographica Section C | 2,000 | 56 | 6 | 670 | 671 | 10.1107/S0108270100000512 | 0.71069 | MoKa | 0.068 | 0.053 | null | 0.1575 | 0.1435 | null | null | null | 1.064 | 1.115 | 1.115 | null | null | null | has coordinates | Paul C. Bell; Marie Drameh; Nicola Hanley; John D. Wallis
Interaction between a dimethylamino group and an electron-deficient alkene in ethyl (<i>E</i>)-2-cyano-3-(8-dimethylamino-1-naphthyl)propenoate
Acta Crystallographica Section C
56(6)
(2000)
670-671 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010991.cif $
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2,010,992 | 13.0339 | 0.0017 | 7.375 | 0.001 | 7.4672 | 0.001 | 90 | null | 91.923 | 0.002 | 90 | null | 717.38 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | 15 | dipotassium dichromate | dipotassium dichromate | - Cr2 K2 O7 - | - Cr2 K2 O7 - | - Cr8 K8 O28 - | 4 | 0.5 | FG1580 | Krivovichev, Sergey V.; Kir'yanova, Elena V.; Filatov, Stanislav K.; Burns, Peter C. | β-K~2~Cr~2~O~7~ | Acta Crystallographica Section C | 2,000 | 56 | 6 | 629 | 630 | 10.1107/S0108270100003917 | 0.71073 | MoKα | 0.032 | 0.029 | null | null | null | 0.084 | null | null | null | null | null | 1.107 | null | null | has coordinates,has Fobs | Krivovichev, Sergey V.; Kir'yanova, Elena V.; Filatov, Stanislav K.; Burns, Peter C.
β-K~2~Cr~2~O~7~
Acta Crystallographica Section C
56(6)
(2000)
629-630 | 282,548 | 2023-04-10 | 20:38:56 | #------------------------------------------------------------------------------
#$Date: 2023-04-10 23:38:45 +0300 (Mon, 10 Apr 2023) $
#$Revision: 282548 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010992.cif $
#-------------------------------------------------------------------... | |||||||||
2,010,993 | 6.7397 | 0.0002 | 7.7777 | 0.0003 | 8.5184 | 0.0003 | 78.5397 | 0.0014 | 85.6376 | 0.0019 | 71.8947 | 0.0018 | 415.91 | 0.03 | 100 | 2 | 100 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | pyrrolidin-2,2-diylbis(phosphonic acid) | - C4 H11 N O6 P2 - | - C4 H11 N O6 P2 - | - C8 H22 N2 O12 P4 - | 2 | 1 | FG1586 | Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre | Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K | Acta Crystallographica Section C | 2,000 | 56 | 6 | 720 | 722 | 10.1107/S0108270100003929 | 0.71073 | MoKα | 0.026 | 0.024 | null | null | null | 0.064 | null | null | null | null | null | 1.065 | null | null | has coordinates,has Fobs | Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre
Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K
Acta Crystallographica Section C
56(6)
(2000)
720-722 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010993.cif $
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2,010,994 | 6.7451 | 0.0002 | 7.7855 | 0.0003 | 8.5197 | 0.0003 | 78.5651 | 0.0014 | 85.6151 | 0.0019 | 71.8678 | 0.0019 | 416.69 | 0.03 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | pyrrolidin-2,2-diylbis(phosphonic acid) | - C4 H11 N O6 P2 - | - C4 H11 N O6 P2 - | - C8 H22 N2 O12 P4 - | 2 | 1 | FG1586 | Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre | Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K | Acta Crystallographica Section C | 2,000 | 56 | 6 | 720 | 722 | 10.1107/S0108270100003929 | 0.71073 | MoKα | 0.026 | 0.024 | null | null | null | 0.064 | null | null | null | null | null | 1.071 | null | null | has coordinates,has Fobs | Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre
Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K
Acta Crystallographica Section C
56(6)
(2000)
720-722 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010994.cif $
#-------------------------------------------------------------------... | ||||||||||
2,010,995 | 6.7703 | 0.0002 | 7.8135 | 0.0002 | 8.5263 | 0.0002 | 78.7105 | 0.0012 | 85.553 | 0.0016 | 71.7958 | 0.0014 | 420.11 | 0.02 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | pyrrolidin-2,2-diylbis(phosphonic acid) | - C4 H11 N O6 P2 - | - C4 H11 N O6 P2 - | - C8 H22 N2 O12 P4 - | 2 | 1 | FG1586 | Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre | Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K | Acta Crystallographica Section C | 2,000 | 56 | 6 | 720 | 722 | 10.1107/S0108270100003929 | 0.71073 | MoKα | 0.026 | 0.024 | null | null | null | 0.065 | null | null | null | null | null | 1.079 | null | null | has coordinates,has Fobs | Olive, Gilles; Ellis, Dianne D.; Siri, Didier; Le Moigne, François; Lutz, Martin; Spek, Anthony L.; Tordo, Paul; Reboul, Jean-Pierre
Zwitterionic pyrrolidine-2,2-diylbis(phosphonic acid) at 100, 150 and 293K
Acta Crystallographica Section C
56(6)
(2000)
720-722 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010995.cif $
#-------------------------------------------------------------------... | ||||||||||
2,010,996 | 8.7242 | 0.0003 | 8.7242 | 0.0003 | 37.102 | 0.003 | 90 | null | 90 | null | 120 | null | 2,445.6 | 0.2 | 295 | 2 | 295 | 2 | null | null | null | null | 6 | P 65 | P 65 | 170 | diaqua(1,7-dioxa-4-thia-10-azacyclododecane)nickel(II) nitrate | - C8 H21 N3 Ni O10 S - | - C8 H21 N3 Ni O10 S - | - C48 H126 N18 Ni6 O60 S6 - | 6 | 1 | FG1589 | Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V. | The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles | Acta Crystallographica Section C | 2,000 | 56 | 6 | 655 | 658 | 10.1107/S0108270100003942 | 0.71073 | MoKα | 0.0504 | 0.0321 | null | null | null | 0.0777 | null | null | null | null | null | 1.055 | null | null | has coordinates,has Fobs | Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V.
The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles
Acta Crystallographica Section C
56(6)
(2000)
655-658 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010996.cif $
#-------------------------------------------------------------------... | ||||||||||
2,010,997 | 8.245 | 0.003 | 11.927 | 0.002 | 14.272 | 0.005 | 90 | null | 96.6 | 0.02 | 90 | null | 1,394.2 | 0.7 | 275 | 2 | 295 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | bis(nitrato)(1,4,7-trioxa-10-azacyclododecane)mercury(II) | - C8 H17 Hg N3 O9 - | - C8 H17 Hg N3 O9 - | - C32 H68 Hg4 N12 O36 - | 4 | 1 | FG1589 | Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V. | The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles | Acta Crystallographica Section C | 2,000 | 56 | 6 | 655 | 658 | 10.1107/S0108270100003942 | 0.71073 | MoKα | 0.0416 | 0.0329 | null | null | null | 0.0873 | null | null | null | null | null | 1.06 | null | null | has coordinates,has Fobs | Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V.
The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles
Acta Crystallographica Section C
56(6)
(2000)
655-658 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010997.cif $
#-------------------------------------------------------------------... | ||||||||||
2,010,998 | 8.6167 | 0.0009 | 9.3975 | 0.0008 | 10.118 | 0.001 | 95.627 | 0.008 | 112.107 | 0.009 | 99.509 | 0.009 | 737.05 | 0.14 | 295 | 2 | 295 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | aqua(1,7-dioxa-4-thia-10-azacyclododecane)nitratocopper(II) nitrate | - C8 H21 Cu N5 O8 - | - C8 H21 Cu N5 O8 - | - C16 H42 Cu2 N10 O16 - | 2 | 1 | FG1589 | Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V. | The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles | Acta Crystallographica Section C | 2,000 | 56 | 6 | 655 | 658 | 10.1107/S0108270100003942 | 0.71073 | MoKα | 0.0275 | 0.0243 | null | null | null | 0.0677 | null | null | null | null | null | 1.082 | null | null | has coordinates,has Fobs | Marcus, Sebastian T.; Gahan, Lawrence R.; Bernhardt, Paul V.
The Ni^II^, Hg^II^ and Cu^II^ complexes of 12-membered-ring mixed-donor macrocycles
Acta Crystallographica Section C
56(6)
(2000)
655-658 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010998.cif $
#-------------------------------------------------------------------... | ||||||||||
2,010,999 | 12.1506 | 0.0007 | 15.404 | 0.0009 | 15.5477 | 0.0009 | 90 | null | 109.199 | 0.001 | 90 | null | 2,748.2 | 0.3 | 183 | 2 | 183 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C30 H16 B F15 Zr - | - C30 H16 B F15 Zr - | - C120 H64 B4 F60 Zr4 - | 4 | 1 | FR1249 | Guzei, Ilia A.; Stockland Jr, Robert A.; Jordan, Richard F. | The bis(η^5^-cyclopentadienyl)methylzirconium(IV) methyltris(pentafluorophenyl)borate ion pair | Acta Crystallographica Section C | 2,000 | 56 | 6 | 635 | 636 | 10.1107/S0108270100001293 | 0.71073 | MoKα | 0.0396 | 0.027 | null | null | null | 0.068 | null | null | null | null | null | 1.002 | null | null | has coordinates,has Fobs | Guzei, Ilia A.; Stockland Jr, Robert A.; Jordan, Richard F.
The bis(η^5^-cyclopentadienyl)methylzirconium(IV) methyltris(pentafluorophenyl)borate ion pair
Acta Crystallographica Section C
56(6)
(2000)
635-636 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010999.cif $
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2,011,000 | 16.942 | 0.001 | 5.932 | 0.002 | 17.265 | 0.001 | 90 | null | 108.122 | 0.005 | 90 | null | 1,649.1 | 0.6 | 296 | null | 296 | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | - C21 H18 O2 - | - C21 H18 O2 - | - C84 H72 O8 - | 4 | 1 | FR1261 | Gerkin, Roger E. | (<i>E</i>)-2-Methyl-5-(1-naphthylmethyl)cinnamic acid | Acta Crystallographica Section C | 2,000 | 56 | 6 | 674 | 676 | 10.1107/S0108270100002778 | 0.71073 | MoKα | null | 0.057 | null | null | null | 0.073 | null | null | null | null | null | 1.36 | null | null | has coordinates | Gerkin, Roger E.
(<i>E</i>)-2-Methyl-5-(1-naphthylmethyl)cinnamic acid
Acta Crystallographica Section C
56(6)
(2000)
674-676 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011000.cif $
#-------------------------------------------------------------------... | |||||||||||
2,011,001 | 11.4104 | 0.0002 | 7.4078 | 0.0001 | 16.9198 | 0.0003 | 90 | null | 107.473 | 0.001 | 90 | null | 1,364.17 | 0.04 | 150 | null | 150 | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 2,2'-dimethoxybiphenyl-5,5'-dimethanol | 2,2'-dimethoxybiphenyl-5,5'-dimethanol | - C16 H18 O4 - | - C16 H18 O4 - | - C64 H72 O16 - | 4 | 1 | FR1262 | Gerkin, Roger E. | Hydrogen bonds and C—H···O interactions in 2,2'-dimethoxybiphenyl-5,5'-dimethanol at 150K | Acta Crystallographica Section C | 2,000 | 56 | 6 | 677 | 678 | 10.1107/S0108270100002900 | 0.71073 | MoKα | null | 0.046 | null | null | null | 0.099 | null | null | null | null | null | 1.99 | null | null | has coordinates,has Fobs | Gerkin, Roger E.
Hydrogen bonds and C—H···O interactions in 2,2'-dimethoxybiphenyl-5,5'-dimethanol at 150K
Acta Crystallographica Section C
56(6)
(2000)
677-678 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011001.cif $
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2,011,002 | 7.187 | 0.001 | 11.261 | 0.002 | 12.812 | 0.003 | 90 | null | 90 | null | 90 | null | 1,036.9 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C12 H10 N2 O2 - | - C12 H10 N2 O2 - | - C48 H40 N8 O8 - | 4 | 1 | GD1082 | Ejsmont, Krzysztof; Domański, Andrzej; Kyzioł, Janusz; Zaleski, Jacek | 4-Hydroxy-<i>ONN</i>-azoxybenzene | Acta Crystallographica Section C | 2,000 | 56 | 6 | 697 | 699 | 10.1107/S0108270100003449 | 0.71073 | MoKα | 0.1092 | 0.0337 | null | null | null | 0.096 | null | null | null | null | null | 0.993 | null | null | has coordinates,has Fobs | Ejsmont, Krzysztof; Domański, Andrzej; Kyzioł, Janusz; Zaleski, Jacek
4-Hydroxy-<i>ONN</i>-azoxybenzene
Acta Crystallographica Section C
56(6)
(2000)
697-699 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011002.cif $
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2,011,003 | 10.276 | 0.002 | 4.677 | 0.001 | 11.296 | 0.002 | 90 | null | 92.22 | 0.02 | 90 | null | 542.49 | 0.18 | 190 | 2 | 190 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | Bis-(2,4-pentanedionato)cobalt(II) | - C10 H14 Co O4 - | - C10 H14 Co O4 - | - C20 H28 Co2 O8 - | 2 | 0.5 | GD1084 | John Burgess; John Fawcett; David R. Russell; Syeda R. Gilani | Monomeric bis(2,4-pentanedionato)cobalt(II) | Acta Crystallographica Section C | 2,000 | 56 | 6 | 649 | 650 | 10.1107/S0108270100003176 | 0.71073 | MoKα | 0.0626 | 0.0515 | null | null | null | 0.1397 | null | null | null | null | null | 1.104 | null | null | has coordinates | John Burgess; John Fawcett; David R. Russell; Syeda R. Gilani
Monomeric bis(2,4-pentanedionato)cobalt(II)
Acta Crystallographica Section C
56(6)
(2000)
649-650 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011003.cif $
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2,011,004 | 16.2046 | 0.0016 | 7.2974 | 0.0005 | 13.509 | 0.0014 | 90 | null | 90 | null | 90 | null | 1,597.5 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P c a 21 | P 2c -2ac | 29 | - C7 H8 Hg Mn N4 O2 S4 - | - C7 H8 Hg Mn N4 O2 S4 - | - C28 H32 Hg4 Mn4 N16 O8 S16 - | 4 | 1 | GD1089 | Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Lu, Meng-Kai; Yuan, Duo-Rong; Lu, Guang-Tian | Manganese mercury thiocyanate (MMTC) glycol monomethyl ether | Acta Crystallographica Section C | 2,000 | 56 | 6 | 647 | 648 | 10.1107/S0108270100003188 | 0.71073 | MoKα | 0.0518 | 0.0395 | null | null | null | 0.1005 | null | null | null | null | null | 1.041 | null | null | has coordinates | Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Lu, Meng-Kai; Yuan, Duo-Rong; Lu, Guang-Tian
Manganese mercury thiocyanate (MMTC) glycol monomethyl ether
Acta Crystallographica Section C
56(6)
(2000)
647-648 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011004.cif $
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2,011,005 | 10.789 | 0.003 | 8.918 | 0.002 | 25.847 | 0.004 | 90 | null | 91.79 | 0.02 | 90 | null | 2,485.7 | 1 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | (12-hydroxymethyl-5,5,7,12,14-pentamethyl-1,4,8,11- tetraazacyclotetradecane-N-acetato-N,N',N'',N''',O,O')cobalt(III) Chloride Perchlorate Monohydrate | - C18 H39 Cl2 Co N4 O8 - | - C18 H39 Cl2 Co N4 O8 - | - C72 H156 Cl8 Co4 N16 O32 - | 4 | 1 | GD1092 | Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun | (12-Hydroxymethyl-5,5,7,12,14-pentamethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>-acetato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''',<i>O</i>,<i>O</i>')cobalt(III) chloride perchlorate monohydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | 659 | 660 | 10.1107/S010827010000398X | 0.71073 | MoKα | 0.0881 | 0.0462 | null | null | null | 0.1087 | null | null | null | null | null | 1.013 | null | null | has coordinates,has Fobs | Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun
(12-Hydroxymethyl-5,5,7,12,14-pentamethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>-acetato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''',<i>O</i>,<i>O</i>')cobalt(III) chloride perchlorate monohydrate
Acta Crystallographica Sectio... | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011005.cif $
#-------------------------------------------------------------------... | ||||||||||
2,011,006 | 11.788 | 0.002 | 6.6204 | 0.0016 | 25.057 | 0.003 | 90 | null | 90 | null | 90 | null | 1,955.5 | 0.6 | 293.2 | null | 293 | 2 | null | null | null | null | 5 | P n a 21 | P 2c -2n | 33 | - C21 H21 N3 O4 S - | - C21 H21 N3 O4 S - | - C84 H84 N12 O16 S4 - | 4 | 1 | GD1093 | Zhao, Yuekun; Helliwell, Madeleine; Joule, John A. | The conversion of a pyrrole trimer derivative into a 4,5,6,7-tetrahydro-4-(pyrrol-2-yl)indol-7-yltosylaminoindole | Acta Crystallographica Section C | 2,000 | 56 | 6 | 714 | 715 | 10.1107/S0108270100003541 | 1.5418 | CuKα | 0.0452 | 0.038 | null | null | null | 0.1071 | null | null | null | null | null | 1.066 | null | null | has coordinates | Zhao, Yuekun; Helliwell, Madeleine; Joule, John A.
The conversion of a pyrrole trimer derivative into a 4,5,6,7-tetrahydro-4-(pyrrol-2-yl)indol-7-yltosylaminoindole
Acta Crystallographica Section C
56(6)
(2000)
714-715 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011006.cif $
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2,011,007 | 8.592 | 0.01 | 8.845 | 0.01 | 11.192 | 0.01 | 109.64 | 0.05 | 90.56 | 0.05 | 103.92 | 0.05 | 773.7 | 1.5 | 100 | 5 | 100 | 5 | null | null | null | null | 5 | P 1 | P 1 | 1 | NAD+ | β-Nicotinamide Adenine Dinucleotide | - C21 H35 N7 O18 P2 - | - C21 H35 N7 O18 P2 - | - C21 H35 N7 O18 P2 - | 1 | 1 | GS1072 | Guillot, Benoit; Jelsch, Christian; Lecomte, Claude | The oxidized form of nicotinamide adenine dinucleotide | Acta Crystallographica Section C | 2,000 | 56 | 6 | 726 | 728 | 10.1107/S0108270100001220 | 0.709 | MoKα | 0.019 | 0.019 | null | null | null | 0.052 | null | null | null | null | null | 1.013 | null | null | has coordinates,has Fobs | Guillot, Benoit; Jelsch, Christian; Lecomte, Claude
The oxidized form of nicotinamide adenine dinucleotide
Acta Crystallographica Section C
56(6)
(2000)
726-728 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,008 | 12.216 | 0.004 | 12.463 | 0.005 | 16.781 | 0.007 | 90 | null | 90 | null | 90 | null | 2,554.9 | 1.7 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | Haperforine B1 | methyl 4-(3,6-dihydro-2,2-dimethyl-6-oxo-2H-pyran-3-ylideneacetyl)-8- furanoyl-5-(1-hydroxyethyl)-4,8-dimethyl-1-oxaspiro[2.5]octane-2-carboxylate | - C27 H32 O9 - | - C27 H32 O9 - | - C108 H128 O36 - | 4 | 1 | GS1076 | Chiaroni, Angèle; Riche, Claude; Khuong-Huu, Qui; Nguyen-Ngoc, Hanh; Nguyen-Viet, Kinh; Khuong-Huu, Françoise | New limonoids from <i>Harrisonia perforata</i> (Blanco) Merr. | Acta Crystallographica Section C | 2,000 | 56 | 6 | 711 | 713 | 10.1107/S0108270100003565 | 1.5418 | CuKα | 0.0516 | 0.0485 | null | 0.1309 | null | 0.1278 | null | null | 1.075 | null | null | 1.087 | null | null | has coordinates | Chiaroni, Angèle; Riche, Claude; Khuong-Huu, Qui; Nguyen-Ngoc, Hanh; Nguyen-Viet, Kinh; Khuong-Huu, Françoise
New limonoids from <i>Harrisonia perforata</i> (Blanco) Merr.
Acta Crystallographica Section C
56(6)
(2000)
711-713 | 201,957 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:48:21 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201957 $
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2,011,009 | 10.148 | 0.005 | 11.225 | 0.007 | 11.356 | 0.008 | 90 | null | 99.44 | 0.02 | 90 | null | 1,276.1 | 1.4 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | Haperforin D | methyl 6'-furanoyl-3-hydroxy-4,4,3',6',7a'-pentamethylperhydro-4H-furo[2,1-c]- pyran-2-spiro-1'-perhydroisobenzofuran-7'-spiro-2''-oxirane-3''-carboxylate | - C27 H34 O10 - | - C27 H34 O10 - | - C54 H68 O20 - | 2 | 1 | GS1076 | Chiaroni, Angèle; Riche, Claude; Khuong-Huu, Qui; Nguyen-Ngoc, Hanh; Nguyen-Viet, Kinh; Khuong-Huu, Françoise | New limonoids from <i>Harrisonia perforata</i> (Blanco) Merr. | Acta Crystallographica Section C | 2,000 | 56 | 6 | 711 | 713 | 10.1107/S0108270100003565 | 1.5418 | CuKα | 0.0703 | 0.0656 | null | 0.1692 | null | 0.1554 | null | null | 1.087 | null | null | 1.089 | null | null | has coordinates,has Fobs | Chiaroni, Angèle; Riche, Claude; Khuong-Huu, Qui; Nguyen-Ngoc, Hanh; Nguyen-Viet, Kinh; Khuong-Huu, Françoise
New limonoids from <i>Harrisonia perforata</i> (Blanco) Merr.
Acta Crystallographica Section C
56(6)
(2000)
711-713 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,010 | 10.947 | 0.005 | 12.185 | 0.005 | 8.883 | 0.005 | 103.808 | 0.005 | 113.331 | 0.005 | 76.135 | 0.005 | 1,042.5 | 0.9 | 296 | 2 | 296 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C20 H24 N2 O4 S2 - | - C20 H24 N2 O4 S2 - | - C40 H48 N4 O8 S4 - | 2 | 1 | JA1020 | Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi | 20-Dicyanomethylene-5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa-1(23),18,21-triene and its mercury(II) dichloride complex | Acta Crystallographica Section C | 2,000 | 56 | 6 | 644 | 646 | 10.1107/S010827010000305X | 1.54184 | CuKα | 0.0394 | 0.0358 | null | null | null | 0.1037 | null | null | null | null | null | 1.101 | null | null | has coordinates,has Fobs | Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi
20-Dicyanomethylene-5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa-1(23),18,21-triene and its mercury(II) dichloride complex
Acta Crystallographica Section C
56(6)
(2000)
644-646 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,011 | 15.387 | 0.005 | 22.349 | 0.005 | 14.579 | 0.005 | 90 | null | 95.337 | 0.005 | 90 | null | 4,992 | 3 | 296 | 2 | 296 | 2 | null | null | null | null | 7 | P 1 21/a 1 | -P 2yab | 14 | - C20 H24 Cl2 Hg N2 O4 S2 - | - C20 H24 Cl2 Hg N2 O4 S2 - | - C160 H192 Cl16 Hg8 N16 O32 S16 - | 8 | 2 | JA1020 | Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi | 20-Dicyanomethylene-5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa-1(23),18,21-triene and its mercury(II) dichloride complex | Acta Crystallographica Section C | 2,000 | 56 | 6 | 644 | 646 | 10.1107/S010827010000305X | 1.54184 | CuKα | 0.1434 | 0.052 | null | null | null | 0.137 | null | null | null | null | null | 1.009 | null | null | has coordinates,has Fobs | Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi
20-Dicyanomethylene-5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa-1(23),18,21-triene and its mercury(II) dichloride complex
Acta Crystallographica Section C
56(6)
(2000)
644-646 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,011,012 | 16.8803 | 0.0005 | 16.1855 | 0.0004 | 19.3262 | 0.0006 | 90 | null | 90 | null | 90 | null | 5,280.2 | 0.3 | 298 | 2 | 298 | 2 | null | null | null | null | 3 | P b c a | -P 2ac 2ab | 61 | 4,13-(1',10'-Decandioxy)hexahelicen | - C36 H34 O2 - | - C36 H34 O2 - | - C288 H272 O16 - | 8 | 1 | JZ1383 | Meier, Herbert; Schwertel, Manfred; Schollmeyer, Dieter | Two strained hexahelicenophanes | Acta Crystallographica Section C | 2,000 | 56 | 6 | 684 | 686 | 10.1107/S0108270100003140 | 1.54178 | CuKα | 0.0709 | 0.0571 | null | 0.1664 | null | 0.1557 | null | null | null | null | null | 1.047 | null | null | has coordinates | Meier, Herbert; Schwertel, Manfred; Schollmeyer, Dieter
Two strained hexahelicenophanes
Acta Crystallographica Section C
56(6)
(2000)
684-686 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,013 | 18.1447 | 0.0004 | 12.3799 | 0.0003 | 10.8228 | 0.0003 | 90 | null | 90 | null | 90 | null | 2,431.12 | 0.1 | 298 | 2 | 298 | 2 | null | null | null | null | 3 | P n a 21 | P 2c -2n | 33 | 4,13-(1,8 octandioxy)-hexahelicen | - C34 H30 O2 - | - C34 H30 O2 - | - C136 H120 O8 - | 4 | 1 | JZ1383 | Meier, Herbert; Schwertel, Manfred; Schollmeyer, Dieter | Two strained hexahelicenophanes | Acta Crystallographica Section C | 2,000 | 56 | 6 | 684 | 686 | 10.1107/S0108270100003140 | 1.54178 | CuKα | 0.0398 | 0.0391 | null | 0.1122 | null | 0.1112 | null | null | null | null | null | 1.068 | null | null | has coordinates,has Fobs | Meier, Herbert; Schwertel, Manfred; Schollmeyer, Dieter
Two strained hexahelicenophanes
Acta Crystallographica Section C
56(6)
(2000)
684-686 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,014 | 11.641 | 0.002 | 11.955 | 0.002 | 3.678 | 0.001 | 90 | null | 90 | null | 90 | null | 511.86 | 0.19 | 150 | null | 150 | null | null | null | null | null | 5 | P b a n :2 | -P 2ab 2b | 50 | 4,4'-bipyridinedichloromanganese(II) | - C10 H8 Cl2 Mn N2 - | - C10 H8 Cl2 Mn N2 - | - C20 H16 Cl4 Mn2 N4 - | 2 | 0.25 | JZ1389 | Chippindale, Ann M.; Cowley, Andrew R.; Peacock, Katherine J. | (4,4'-Bipyridine)dichloromanganese(II), a two-dimensional coordination polymer | Acta Crystallographica Section C | 2,000 | 56 | 6 | 651 | 652 | 10.1107/S0108270100003474 | 0.71069 | MoKα | null | 0.033 | null | null | 0.038 | null | null | null | null | 1.0537 | 1.0537 | null | null | null | has coordinates,has Fobs | Chippindale, Ann M.; Cowley, Andrew R.; Peacock, Katherine J.
(4,4'-Bipyridine)dichloromanganese(II), a two-dimensional coordination polymer
Acta Crystallographica Section C
56(6)
(2000)
651-652 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
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2,011,015 | 9.324 | 0.002 | 25.149 | 0.003 | 11.753 | 0.002 | 90 | null | 108 | 0.05 | 90 | null | 2,621.1 | 1.1 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | oxazol-5(4H)-one from Z-(Aib)~4~-OH | benzyl N-[8-(4,4-dimethyl-5-oxooxazol-2-yl)-2,5,5,8-tetramethyl-3,6-dioxo-4,7- diazanon-2-yl]carbamate | - C24 H34 N4 O6 - | - C24 H34 N4 O6 - | - C96 H136 N16 O24 - | 4 | 1 | LN1097 | Crisma, Marco; Formaggio, Fernando; Toniolo, Claudio | An oxazol-5(4<i>H</i>)-one from benzyloxycarbonyl-(Aib)~4~-OH | Acta Crystallographica Section C | 2,000 | 56 | 6 | 695 | 696 | 10.1107/S0108270100003413 | 0.71073 | MoKα | 0.071 | 0.043 | null | null | null | 0.132 | null | null | null | null | null | 1.003 | null | null | has coordinates,has Fobs | Crisma, Marco; Formaggio, Fernando; Toniolo, Claudio
An oxazol-5(4<i>H</i>)-one from benzyloxycarbonyl-(Aib)~4~-OH
Acta Crystallographica Section C
56(6)
(2000)
695-696 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,016 | 10.1318 | 0.0002 | 13.2019 | 0.0002 | 14.9565 | 0.0005 | 77.207 | 0.001 | 80.992 | 0.002 | 76.834 | 0.002 | 1,887.72 | 0.08 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | (Piperidine-1-carbodithioato-S,S')bis(triphenylphosphine-P)gold(I) | - C42 H40 Au N P2 S2 - | - C42 H40 Au N P2 S2 - | - C84 H80 Au2 N2 P4 S4 - | 2 | 1 | LN1100 | Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Jian, Fangfang; Bei, Fengli; Yang, Xujie; Lu, Lude; Wang, Xin | (Piperidine-1-carbodithioato-<i>S</i>,<i>S</i>')bis(triphenylphosphine-<i>P</i>)gold(I) | Acta Crystallographica Section C | 2,000 | 56 | 6 | 666 | 667 | 10.1107/S0108270100003760 | 0.71073 | MoKα | 0.09 | 0.054 | null | null | null | 0.124 | null | null | null | null | null | 0.89 | null | null | has coordinates,has Fobs | Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Jian, Fangfang; Bei, Fengli; Yang, Xujie; Lu, Lude; Wang, Xin
(Piperidine-1-carbodithioato-<i>S</i>,<i>S</i>')bis(triphenylphosphine-<i>P</i>)gold(I)
Acta Crystallographica Section C
56(6)
(2000)
666-667 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011016.cif $
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2,011,017 | 12.5502 | 0.0007 | 9.5832 | 0.0005 | 15.395 | 0.0008 | 90 | null | 95.734 | 0.001 | 90 | null | 1,842.31 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | [Co(en)~3~](C~2~O~4~)(ClO~4~)(H~2~O)~2~ | Tris(ethylenediamine) cobalt (III) oxalato perchlorate dihydrate | - C8 H28 Cl Co N6 O10 - | - C8 H28 Cl Co N6 O10 - | - C32 H112 Cl4 Co4 N24 O40 - | 4 | 1 | LN1103 | Cai, Jiwen; Zhang, Yufei; Hu, Xiaopeng; Feng, Xiaolong | Tris(ethylenediamine-<i>N</i>,<i>N</i>')cobalt(III) oxalate perchlorate dihydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | 661 | 663 | 10.1107/S0108270100004200 | 0.71073 | MoKα | 0.0396 | 0.0306 | null | null | null | 0.09 | null | null | null | null | null | 1.024 | null | null | has coordinates,has Fobs | Cai, Jiwen; Zhang, Yufei; Hu, Xiaopeng; Feng, Xiaolong
Tris(ethylenediamine-<i>N</i>,<i>N</i>')cobalt(III) oxalate perchlorate dihydrate
Acta Crystallographica Section C
56(6)
(2000)
661-663 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,018 | 12.52 | 0.02 | 6.944 | 0.001 | 12.919 | 0.001 | 90 | null | 90 | null | 90 | null | 1,123.2 | 1.8 | 123.2 | null | null | null | null | null | null | null | 4 | P n a 21 | P 2c -2n | 33 | - C9 H22 B P - | - C9 H22 B P - | - C36 H88 B4 P4 - | 4 | 1 | OA1100 | Atsushi Ohashi; Tsuneo Imamoto | 1-<i>tert</i>-Butyl-2-methylphospholane–borane and its coupling product 2,2'-bis(1-<i>tert</i>-butylphospholane–borane) | Acta Crystallographica Section C | 2,000 | 56 | 6 | 723 | 725 | 10.1107/S0108270100004066 | 1.5418 | CuKα | null | 0.0391 | null | null | null | 0.0495 | null | null | null | null | null | 1.913 | null | null | has coordinates,has Fobs | Atsushi Ohashi; Tsuneo Imamoto
1-<i>tert</i>-Butyl-2-methylphospholane–borane and its coupling product 2,2'-bis(1-<i>tert</i>-butylphospholane–borane)
Acta Crystallographica Section C
56(6)
(2000)
723-725 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,019 | 10.346 | 0.001 | 9.796 | 0.002 | 20.597 | 0.001 | 90 | null | 100.805 | 0.008 | 90 | null | 2,050.5 | 0.5 | 296.2 | null | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | - C16 H38 B2 P2 - | - C16 H38 B2 P2 - | - C64 H152 B8 P8 - | 4 | 0.5 | OA1100 | Atsushi Ohashi; Tsuneo Imamoto | 1-<i>tert</i>-Butyl-2-methylphospholane–borane and its coupling product 2,2'-bis(1-<i>tert</i>-butylphospholane–borane) | Acta Crystallographica Section C | 2,000 | 56 | 6 | 723 | 725 | 10.1107/S0108270100004066 | 1.5418 | CuKα | null | 0.0479 | null | null | null | 0.0583 | null | null | null | null | null | 1.787 | null | null | has coordinates,has Fobs | Atsushi Ohashi; Tsuneo Imamoto
1-<i>tert</i>-Butyl-2-methylphospholane–borane and its coupling product 2,2'-bis(1-<i>tert</i>-butylphospholane–borane)
Acta Crystallographica Section C
56(6)
(2000)
723-725 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,020 | 7.092 | 0.008 | 30.78 | 0.03 | 7.126 | 0.007 | 90 | null | 116.96 | 0.12 | 90 | null | 1,386 | 3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | cis-(Malonato)[(4R,5R)-4,5-bis(aminomethyl)-2,2-dimethyl- 1,3-dioxolane]platinum(II) | - C10 H18 N2 O6 Pt - | - C10 H18 N2 O6 Pt - | - C40 H72 N8 O24 Pt4 - | 4 | 2 | OB1028 | Cho, Sang Woo; Cho, Yongkee; Kim, Dae-Kee; Shin, Whanchul | <i>cis</i>-[(4<i>R</i>,5<i>R</i>)-4,5-Bis(aminomethyl)-2,2-dimethyl-1,3-dioxolane-<i>N</i>,<i>N</i>'](malonato-<i>O</i>,<i>O</i>')platinum(II), an anticancer agent | Acta Crystallographica Section C | 2,000 | 56 | 6 | 653 | 654 | 10.1107/S0108270100003577 | 0.71073 | MoKα | 0.058 | 0.046 | null | null | null | 0.108 | null | null | null | null | null | 1.03 | null | null | has coordinates,has Fobs | Cho, Sang Woo; Cho, Yongkee; Kim, Dae-Kee; Shin, Whanchul
<i>cis</i>-[(4<i>R</i>,5<i>R</i>)-4,5-Bis(aminomethyl)-2,2-dimethyl-1,3-dioxolane-<i>N</i>,<i>N</i>'](malonato-<i>O</i>,<i>O</i>')platinum(II), an anticancer agent
Acta Crystallographica Section C
56(6)
(2000)
653-654 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011020.cif $
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2,011,021 | 14.463 | 0.004 | 5.805 | 0.002 | 20.927 | 0.007 | 90 | null | 101.27 | 0.04 | 90 | null | 1,723.1 | 1 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | Octa-O-acetyl β,β-thio-Trehalose | - C28 H38 O18 S - | - C28 H38 O18 S - | - C56 H76 O36 S2 - | 2 | 1 | OS1094 | Färnbäck, Magnus; Eriksson, Lars; Widmalm, Göran | Octa-<i>O</i>-acetyl-β,β-thiotrehalose | Acta Crystallographica Section C | 2,000 | 56 | 6 | 700 | 701 | 10.1107/S0108270100003681 | 0.71073 | MoKα | 0.2942 | 0.0551 | null | null | null | 0.1235 | null | null | null | null | null | 1.321 | null | null | has coordinates | Färnbäck, Magnus; Eriksson, Lars; Widmalm, Göran
Octa-<i>O</i>-acetyl-β,β-thiotrehalose
Acta Crystallographica Section C
56(6)
(2000)
700-701 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011021.cif $
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2,011,022 | 23.343 | 0.009 | 4.7027 | 0.0009 | 14.935 | 0.006 | 90 | null | 104.36 | 0.05 | 90 | null | 1,588.3 | 1 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | C 1 2 1 | C 2y | 5 | Methyl 4-O-β-L-fucopyranosyl α-D-glucopyranoside hemihydrate | - C13 H25 O10.5 - | - C13 H25 O10.5 - | - C52 H100 O42 - | 4 | 1 | OS1102 | Eriksson, Lars; Stenutz, Roland; Widmalm, Göran | Methyl 4-<i>O</i>-β-<small>L</small>-fucopyranosyl α-<small>D</small>-glucopyranoside hemihydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | 702 | 704 | 10.1107/S0108270100003589 | 0.71073 | MoKα | 0.051 | 0.035 | null | null | null | 0.09 | null | null | null | null | null | 1.041 | null | null | has coordinates,has Fobs | Eriksson, Lars; Stenutz, Roland; Widmalm, Göran
Methyl 4-<i>O</i>-β-<small>L</small>-fucopyranosyl α-<small>D</small>-glucopyranoside hemihydrate
Acta Crystallographica Section C
56(6)
(2000)
702-704 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,023 | 7.325 | 0.003 | 7.982 | 0.004 | 13.452 | 0.006 | 74.44 | 0.04 | 87.05 | 0.03 | 80.3 | 0.03 | 746.8 | 0.6 | 100 | 2 | 100 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C18 H13 N5 - | - C18 H13 N5 - | - C36 H26 N10 - | 2 | 1 | OS1110 | Dahl, Tor | Intermolecular interactions and molecular geometry in molecular complexes of <i>N</i>,<i>N</i>-dimethylaniline: the 1:1 complex with 1,2,4,5-tetracyanobenzene | Acta Crystallographica Section C | 2,000 | 56 | 6 | 708 | 710 | 10.1107/S0108270100003590 | 0.71069 | MoKα | 0.0732 | 0.0427 | null | null | null | 0.1498 | null | null | null | null | null | 1.066 | null | null | has coordinates | Dahl, Tor
Intermolecular interactions and molecular geometry in molecular complexes of <i>N</i>,<i>N</i>-dimethylaniline: the 1:1 complex with 1,2,4,5-tetracyanobenzene
Acta Crystallographica Section C
56(6)
(2000)
708-710 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,024 | 47.7172 | 0.0011 | 10.3463 | 0.0002 | 33.7261 | 0.0008 | 90 | null | 133.694 | 0.008 | 90 | null | 12,038.9 | 1.7 | 150 | 2 | 150 | 2 | null | null | null | null | 7 | C 1 2/c 1 | -C 2yc | 15 | o-benzoquinonediimine-dichloro-bis(triphenylphosphine)ruthenium(II) | - C43.67 H42 Cl2.67 N2 O1.33 P2 Ru - | - C43.3333 H41.3333 Cl2 N2 O1.33333 P2 Ru - | - C520 H496 Cl24 N24 O16 P24 Ru12 - | 12 | 1.5 | QA0217 | Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Vega, Andrés; Latorre, Ramón | (<i>o</i>-Benzoquinone diimine-<i>N</i>,<i>N</i>')dichlorobis(triphenylphosphine-<i>P</i>)ruthenium(II) 1.33-methanol 0.33-dichloromethane solvate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e245 | e246 | 10.1107/S0108270100006144 | 0.71073 | MoKα | 0.075 | 0.041 | null | null | null | 0.106 | null | null | null | null | null | 0.991 | null | null | has coordinates,has Fobs | Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Vega, Andrés; Latorre, Ramón
(<i>o</i>-Benzoquinone diimine-<i>N</i>,<i>N</i>')dichlorobis(triphenylphosphine-<i>P</i>)ruthenium(II) 1.33-methanol 0.33-dichloromethane solvate
Acta Crystallographica Section C
56(6)
(2000)
e245-e246 | 194,583 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-03-29 15:46:26 +0300 (Wed, 29 Mar 2017) $
#$Revision: 194583 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011024.cif $
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2,011,025 | 3.8515 | 0.0003 | 11.0201 | 0.0008 | 12.7303 | 0.0009 | 90 | null | 92.312 | 0.002 | 90 | null | 539.88 | 0.07 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | - C12 H10 N4 - | - C12 H10 N4 - | - C24 H20 N8 - | 2 | 0.5 | QA0228 | Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zhang, Jing; Xiong, Ren-Geng; You, Xiao-Zeng | Pyridine-4-carbaldehyde azine | Acta Crystallographica Section C | 2,000 | 56 | 6 | e274 | e275 | 10.1107/S0108270100007046 | 0.71073 | MoKα | 0.079 | 0.067 | null | null | null | 0.11 | null | null | null | null | null | 1.247 | null | null | has coordinates,has Fobs | Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Zhang, Jing; Xiong, Ren-Geng; You, Xiao-Zeng
Pyridine-4-carbaldehyde azine
Acta Crystallographica Section C
56(6)
(2000)
e274-e275 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,026 | 7.136 | 0.003 | 23.71 | 0.003 | 25.964 | 0.004 | 90 | null | 90 | null | 90 | null | 4,393 | 2 | 298 | 1 | null | null | null | null | null | null | 4 | P b c a | -P 2ac 2ab | 61 | propane-1,3-diammonium bis[(E)-3-(3-nitrophenyl)propenoate] | - C21 H24 N4 O8 - | - C21 H24 N4 O8 - | - C168 H192 N32 O64 - | 8 | 1 | QA0234 | Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu | 1,3-Propanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) and <i>trans</i>-1,2-cyclohexanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) | Acta Crystallographica Section C | 2,000 | 56 | 6 | e260 | e261 | 10.1107/S0108270100006120 | 0.71073 | MoKα | null | 0.056 | null | null | null | 0.167 | null | null | null | null | null | 1.03 | null | null | has coordinates,has Fobs | Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu
1,3-Propanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) and <i>trans</i>-1,2-cyclohexanediammonium bis(3'-nitro-<i>trans</i>-cinnamate)
Acta Crystallographica Section C
56(6)
(2000)
e260-e261 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,027 | 26.919 | 0.004 | 7.572 | 0.003 | 11.966 | 0.003 | 90 | null | 90 | null | 90 | null | 2,439 | 1.2 | 298 | 1 | null | null | null | null | null | null | 4 | P b c n | -P 2n 2ab | 60 | trans-cyclohexane-1,2-diammonium bis[(E)-3-(3-nitrophenyl)propenoate] | - C24 H28 N4 O8 - | - C24 H28 N4 O8 - | - C96 H112 N16 O32 - | 4 | 0.5 | QA0234 | Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu | 1,3-Propanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) and <i>trans</i>-1,2-cyclohexanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) | Acta Crystallographica Section C | 2,000 | 56 | 6 | e260 | e261 | 10.1107/S0108270100006120 | 0.71073 | MoKα | null | 0.074 | null | null | null | 0.19 | null | null | null | null | null | 1.77 | null | null | has coordinates,has disorder,has Fobs | Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu
1,3-Propanediammonium bis(3'-nitro-<i>trans</i>-cinnamate) and <i>trans</i>-1,2-cyclohexanediammonium bis(3'-nitro-<i>trans</i>-cinnamate)
Acta Crystallographica Section C
56(6)
(2000)
e260-e261 | 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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2,011,028 | 8.1341 | 0.0012 | 13.4171 | 0.0019 | 9.2291 | 0.0014 | 90 | null | 90 | null | 90 | null | 1,007.2 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P n a 21 | P 2c -2n | 33 | - C9 H12 N4 - | - C9 H12 N4 - | - C36 H48 N16 - | 4 | 1 | QA0267 | Xu, An-Wu; Cai, Yue-Peng; Su, Cheng-Yong; Liu, Hong-Ke | Tris(2-cyanoethyl)amine | Acta Crystallographica Section C | 2,000 | 56 | 6 | e262 | e262 | 10.1107/S0108270100006156 | 0.71073 | MoKα | 0.047 | 0.033 | null | null | null | 0.081 | null | null | null | null | null | 0.995 | null | null | has coordinates,has Fobs | Xu, An-Wu; Cai, Yue-Peng; Su, Cheng-Yong; Liu, Hong-Ke
Tris(2-cyanoethyl)amine
Acta Crystallographica Section C
56(6)
(2000)
e262-e262 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,029 | 13.658 | 0.002 | 14.199 | 0.003 | 11.72 | 0.003 | 104.92 | 0.02 | 112.08 | 0.02 | 68.32 | 0.01 | 1,938.5 | 0.8 | 299 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C17 H17 Cl2 Cu N3 O5 - | - C17 H17 Cl2 Cu N3 O5 - | - C68 H68 Cl8 Cu4 N12 O20 - | 4 | 2 | QA0275 | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo | Four copper(II) complexes with potentially tetradentate tripodal ligands | Acta Crystallographica Section C | 2,000 | 56 | 6 | e233 | e235 | 10.1107/S010827010000603X | 0.71073 | MoKα | null | 0.046 | null | null | null | 0.148 | null | null | null | null | null | 0.99 | null | null | has coordinates | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo
Four copper(II) complexes with potentially tetradentate tripodal ligands
Acta Crystallographica Section C
56(6)
(2000)
e233-e235 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,011,030 | 23.377 | 0.004 | 9.204 | 0.002 | 16.361 | 0.003 | 90 | null | 102.43 | 0.01 | 90 | null | 3,437.7 | 1.1 | 295 | null | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | - C28 H34 Cl6 Cu3 N6 O2 - | - C28 H34 Cl6 Cu3 N6 O2 - | - C112 H136 Cl24 Cu12 N24 O8 - | 4 | 0.5 | QA0275 | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo | Four copper(II) complexes with potentially tetradentate tripodal ligands | Acta Crystallographica Section C | 2,000 | 56 | 6 | e233 | e235 | 10.1107/S010827010000603X | 0.71073 | MoKα | null | 0.04 | null | null | null | 0.131 | null | null | null | null | null | 1 | null | null | has coordinates,has Fobs | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo
Four copper(II) complexes with potentially tetradentate tripodal ligands
Acta Crystallographica Section C
56(6)
(2000)
e233-e235 | 219,800 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2019-10-28 09:23:29 +0200 (Mon, 28 Oct 2019) $
#$Revision: 219800 $
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2,011,031 | 9.282 | 0.003 | 11.592 | 0.004 | 19.731 | 0.003 | 90 | null | 90.76 | 0.02 | 90 | null | 2,122.8 | 1.1 | 299 | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C18 H24 Cl2 Cu N4 O5 - | - C18 H24 Cl2 Cu N4 O5 - | - C72 H96 Cl8 Cu4 N16 O20 - | 4 | 1 | QA0275 | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo | Four copper(II) complexes with potentially tetradentate tripodal ligands | Acta Crystallographica Section C | 2,000 | 56 | 6 | e233 | e235 | 10.1107/S010827010000603X | 0.71073 | MoKα | null | 0.049 | null | null | null | 0.197 | null | null | null | null | null | 1.32 | null | null | has coordinates,has Fobs | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo
Four copper(II) complexes with potentially tetradentate tripodal ligands
Acta Crystallographica Section C
56(6)
(2000)
e233-e235 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,011,032 | 11.855 | 0.003 | 15.258 | 0.002 | 13.186 | 0.003 | 90 | null | 105.14 | 0.02 | 90 | null | 2,302.3 | 0.9 | 299 | null | null | null | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | - C19 H26 Cl Cu F6 N4 P - | - C19 H26 Cl Cu F6 N4 P - | - C76 H104 Cl4 Cu4 F24 N16 P4 - | 4 | 1 | QA0275 | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo | Four copper(II) complexes with potentially tetradentate tripodal ligands | Acta Crystallographica Section C | 2,000 | 56 | 6 | e233 | e235 | 10.1107/S010827010000603X | 0.71073 | MoKα | null | 0.045 | null | null | null | 0.147 | null | null | null | null | null | 0.99 | null | null | has coordinates,has Fobs | Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo
Four copper(II) complexes with potentially tetradentate tripodal ligands
Acta Crystallographica Section C
56(6)
(2000)
e233-e235 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011032.cif $
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2,011,033 | 9.7989 | 0.0002 | 15.016 | 0.0005 | 17.7189 | 0.0005 | 90 | null | 104.595 | 0.0016 | 90 | null | 2,523.04 | 0.12 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C28 H16 Mn N10 - | - C28 H16 Mn N10 - | - C112 H64 Mn4 N40 - | 4 | 1 | QA0283 | Wang, Zhe-Ming; Luo Jun; Sun Bai-Wang; Yan Chun-Hua; Liao Chun-Sheng; Gao Song | <i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)manganese(II) and <i>cis</i>-bis(dicyanamido)bis(1,10-phenanthroline)zinc(II) | Acta Crystallographica Section C | 2,000 | 56 | 6 | e242 | e244 | 10.1107/S0108270100006132 | 0.71073 | MoKα | 0.088 | 0.045 | null | null | null | 0.11 | null | null | null | null | null | 1.008 | null | null | has coordinates,has Fobs | Wang, Zhe-Ming; Luo Jun; Sun Bai-Wang; Yan Chun-Hua; Liao Chun-Sheng; Gao Song
<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)manganese(II) and <i>cis</i>-bis(dicyanamido)bis(1,10-phenanthroline)zinc(II)
Acta Crystallographica Section C
56(6)
(2000)
e242-e244 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,034 | 9.68 | 0.0003 | 15.0697 | 0.0007 | 17.7166 | 0.0008 | 90 | null | 104.628 | 0.002 | 90 | null | 2,500.63 | 0.18 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C28 H16 N10 Zn - | - C28 H16 N10 Zn - | - C112 H64 N40 Zn4 - | 4 | 1 | QA0283 | Wang, Zhe-Ming; Luo Jun; Sun Bai-Wang; Yan Chun-Hua; Liao Chun-Sheng; Gao Song | <i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)manganese(II) and <i>cis</i>-bis(dicyanamido)bis(1,10-phenanthroline)zinc(II) | Acta Crystallographica Section C | 2,000 | 56 | 6 | e242 | e244 | 10.1107/S0108270100006132 | 0.71073 | MoKα | 0.086 | 0.045 | null | null | null | 0.087 | null | null | null | null | null | 1.027 | null | null | has coordinates,has Fobs | Wang, Zhe-Ming; Luo Jun; Sun Bai-Wang; Yan Chun-Hua; Liao Chun-Sheng; Gao Song
<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)manganese(II) and <i>cis</i>-bis(dicyanamido)bis(1,10-phenanthroline)zinc(II)
Acta Crystallographica Section C
56(6)
(2000)
e242-e244 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,035 | 13.659 | 0.002 | 10.045 | 0.002 | 9.4366 | 0.0016 | 90 | null | 108.205 | 0.018 | 90 | null | 1,229.9 | 0.4 | 180 | 2 | 180 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Dimethylphenylsulfonium trifluormethansulfonate | - C9 H11 F3 O3 S2 - | - C9 H11 F3 O3 S2 - | - C36 H44 F12 O12 S8 - | 4 | 1 | QA0284 | Schulze-Matthäi, Kerstin; Bendig, Jürgen; Neubauer, Petra; Ziemer, Burkhard | Dimethylphenylsulfonium trifluoromethanesulfonate and methyldiphenylsulfonium trifluoromethanesulfonate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e257 | e258 | 10.1107/S0108270100006077 | 0.71073 | MoKα | 0.049 | 0.044 | null | null | null | 0.125 | null | null | null | null | null | 1.056 | null | null | has coordinates,has Fobs | Schulze-Matthäi, Kerstin; Bendig, Jürgen; Neubauer, Petra; Ziemer, Burkhard
Dimethylphenylsulfonium trifluoromethanesulfonate and methyldiphenylsulfonium trifluoromethanesulfonate
Acta Crystallographica Section C
56(6)
(2000)
e257-e258 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,036 | 12.5122 | 0.0013 | 9.0284 | 0.0006 | 15.3932 | 0.0014 | 90 | null | 113.552 | 0.008 | 90 | null | 1,594 | 0.3 | 180 | 2 | 180 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Methyldiphenylsulfonium trifluoromethansulfonate | - C14 H13 F3 O3 S2 - | - C14 H13 F3 O3 S2 - | - C56 H52 F12 O12 S8 - | 4 | 1 | QA0284 | Schulze-Matthäi, Kerstin; Bendig, Jürgen; Neubauer, Petra; Ziemer, Burkhard | Dimethylphenylsulfonium trifluoromethanesulfonate and methyldiphenylsulfonium trifluoromethanesulfonate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e257 | e258 | 10.1107/S0108270100006077 | 0.71073 | MoKα | 0.036 | 0.031 | null | null | null | 0.082 | null | null | null | null | null | 1.066 | null | null | has coordinates,has Fobs | Schulze-Matthäi, Kerstin; Bendig, Jürgen; Neubauer, Petra; Ziemer, Burkhard
Dimethylphenylsulfonium trifluoromethanesulfonate and methyldiphenylsulfonium trifluoromethanesulfonate
Acta Crystallographica Section C
56(6)
(2000)
e257-e258 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,037 | 17.843 | 0.004 | 7.2015 | 0.0014 | 33.176 | 0.007 | 90 | null | 95.59 | 0.03 | 90 | null | 4,242.7 | 1.6 | 293 | 2 | 29 | null | null | null | null | null | 2 | C 1 2/c 1 | -C 2yc | 15 | tris-(4-Tolyl)phenylmethane | tris-(4-Tolyl)phenylmethane | - C28 H26 - | - C28 H26 - | - C224 H208 - | 8 | 1 | QA0285 | Jetti, Ram K. R.; Nangia, Ashwini | [Tris(4-tolyl)methyl]benzene | Acta Crystallographica Section C | 2,000 | 56 | 6 | e259 | e259 | 10.1107/S0108270100006090 | 0.71073 | MoKα | 0.098 | 0.057 | null | null | null | 0.173 | null | null | null | null | null | 1.153 | null | null | has coordinates,has Fobs | Jetti, Ram K. R.; Nangia, Ashwini
[Tris(4-tolyl)methyl]benzene
Acta Crystallographica Section C
56(6)
(2000)
e259-e259 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,011,038 | 8.96 | 0.001 | 8.96 | 0.001 | 16.617 | 0.004 | 90 | null | 90 | null | 90 | null | 1,334 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | I 4/m c m | -I 4 2c | 140 | Potassium Barium Bismuth oxide | - Ba4 Bi3 K O - | - Ba4 Bi3 K O - | - Ba16 Bi12 K4 O4 - | 4 | 0.125 | QA0287 | Derrien, Gaelle; Tillard, Monique; Monconduit, Laure; Belin, Claude | Potassium barium bismuth oxide | Acta Crystallographica Section C | 2,000 | 56 | 6 | e232 | e232 | 10.1107/S0108270100006855 | 0.71069 | MoKα | 0.072 | 0.046 | null | null | null | 0.112 | null | null | null | null | null | 1.064 | null | null | has coordinates,has Fobs | Derrien, Gaelle; Tillard, Monique; Monconduit, Laure; Belin, Claude
Potassium barium bismuth oxide
Acta Crystallographica Section C
56(6)
(2000)
e232-e232 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,011,039 | 25.0892 | 0.0018 | 11.0572 | 0.0008 | 22.0033 | 0.0015 | 90 | null | 111.395 | 0.002 | 90 | null | 5,683.4 | 0.7 | 100 | null | 100 | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | (η^5^-(2-(p-tolyl)prop-2-yl)cyclopentadienyl)-tribenzylzirconium | - C36 H38 Zr - | - C36 H38 Zr - | - C288 H304 Zr8 - | 8 | 2 | QA0288 | Sassmannshausen, Jörg; Rust, Jörg; Goddard, Richard | Tribenzyl{η^5^-[2-(<i>p</i>-tolyl)prop-2-yl]cyclopentadienyl}zirconium | Acta Crystallographica Section C | 2,000 | 56 | 6 | e236 | e237 | 10.1107/S0108270100006089 | 0.71073 | MoKα | 0.084 | 0.044 | null | null | null | 0.1 | null | null | null | null | null | 1.016 | null | null | has coordinates,has Fobs | Sassmannshausen, Jörg; Rust, Jörg; Goddard, Richard
Tribenzyl{η^5^-[2-(<i>p</i>-tolyl)prop-2-yl]cyclopentadienyl}zirconium
Acta Crystallographica Section C
56(6)
(2000)
e236-e237 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,011,040 | 6.9867 | 0.0001 | 6.3049 | 0.0001 | 25.233 | 0.0001 | 90 | null | 91.7544 | 0.0008 | 90 | null | 1,111 | 0.02 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | Hexaaquacobalt(II) 4-Toluenesulfonate | - C14 H26 Co O12 S2 - | - C14 H26 Co O12 S2 - | - C28 H52 Co2 O24 S4 - | 2 | 0.5 | QA0289 | Cabaleiro-Martínez, Santiago; Castro, Jesús; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio | Hexaaquacobalt(II) bis(4-toluenesulfonate) | Acta Crystallographica Section C | 2,000 | 56 | 6 | e249 | e250 | 10.1107/S0108270100006600 | 0.71073 | MoKα | 0.041 | 0.036 | null | null | null | 0.098 | null | null | null | null | null | 1.012 | null | null | has coordinates,has Fobs | Cabaleiro-Martínez, Santiago; Castro, Jesús; Romero, Jaime; García-Vázquez, José A.; Sousa, Antonio
Hexaaquacobalt(II) bis(4-toluenesulfonate)
Acta Crystallographica Section C
56(6)
(2000)
e249-e250 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,041 | 9.1481 | 0.0009 | 24.877 | 0.002 | 7.225 | 0.001 | 90 | null | 90.82 | 0.01 | 90 | null | 1,644.1 | 0.3 | 292 | 1 | 292 | 1 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | n-butylammonium dihydrogenphosphate | - C4 H14 N O4 P - | - C4 H14 N O4 P - | - C32 H112 N8 O32 P8 - | 8 | 2 | QA0290 | Fábry, Jan; Císařová, Ivana; Kroupa, Jan | Ferroelastic <i>n</i>-butylammonium dihydrogenphosphate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e263 | e264 | 10.1107/S0108270100006326 | 0.71073 | MoKα | 0.459 | 0.0308 | null | 0.0423 | null | 0.0423 | null | null | 2.13 | 2.39 | 2.39 | 2.13 | null | null | has coordinates,has Fobs | Fábry, Jan; Císařová, Ivana; Kroupa, Jan
Ferroelastic <i>n</i>-butylammonium dihydrogenphosphate
Acta Crystallographica Section C
56(6)
(2000)
e263-e264 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,042 | 10.4676 | 0.0018 | 10.4774 | 0.0015 | 10.5727 | 0.0018 | 71.878 | 0.012 | 64.619 | 0.012 | 69.533 | 0.012 | 963.5 | 0.3 | 193 | 2 | 193 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C10 H10 O5 - | - C10 H10 O5 - | - C40 H40 O20 - | 4 | 2 | QA0291 | Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J. | 3-Acetoxycyclohex-4-ene-1,2-dicarboxylic anhydride | Acta Crystallographica Section C | 2,000 | 56 | 6 | e265 | e266 | 10.1107/S0108270100006430 | 0.71069 | MoKα | 0.069 | 0.039 | null | null | null | 0.118 | null | null | null | null | null | 1.006 | null | null | has coordinates,has Fobs | Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.
3-Acetoxycyclohex-4-ene-1,2-dicarboxylic anhydride
Acta Crystallographica Section C
56(6)
(2000)
e265-e266 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,043 | 9.975 | 0.002 | 7.186 | 0.002 | 24.267 | 0.006 | 90 | null | 98.78 | 0.01 | 90 | null | 1,719.1 | 0.7 | 120 | 2 | 120 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | mineral hexahydrite | magnesium sulfate hexahydrate | - H12 Mg O10 S - | - H12 Mg O10 S - | - H96 Mg8 O80 S8 - | 8 | 1 | QA0292 | Batsanov, Andrei S. | Magnesium sulfate hexahydrate at 120K | Acta Crystallographica Section C | 2,000 | 56 | 6 | e230 | e231 | 10.1107/S0108270100006442 | 0.71073 | MoKα | 0.03 | 0.029 | null | null | null | 0.078 | null | null | null | null | null | 1.189 | null | null | has coordinates,has Fobs | Batsanov, Andrei S.
Magnesium sulfate hexahydrate at 120K
Acta Crystallographica Section C
56(6)
(2000)
e230-e231 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
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2,011,044 | 5.479 | 0.002 | 10.84 | 0.004 | 11.159 | 0.003 | 90 | null | 104.12 | 0.01 | 90 | null | 642.7 | 0.4 | 295 | 2 | 295 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 3,5-difluoro-4-nitropyridine N-oxide | - C5 H2 F2 N2 O3 - | - C5 H2 F2 N2 O3 - | - C20 H8 F8 N8 O12 - | 4 | 1 | QA0293 | Batsanov, Andrei S. | 3,5-Difluoro-4-nitropyridine <i>N</i>-oxide and 3,5-diamino-4-nitropyridine <i>N</i>-oxide monohydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e269 | e270 | 10.1107/S0108270100006636 | 0.71073 | MoKα | 0.064 | 0.04 | null | null | null | 0.104 | null | null | null | null | null | 1.143 | null | null | has coordinates,has Fobs | Batsanov, Andrei S.
3,5-Difluoro-4-nitropyridine <i>N</i>-oxide and 3,5-diamino-4-nitropyridine <i>N</i>-oxide monohydrate
Acta Crystallographica Section C
56(6)
(2000)
e269-e270 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,045 | 7 | 0.001 | 13.123 | 0.001 | 8.263 | 0.001 | 90 | null | 90 | null | 90 | null | 759.05 | 0.15 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | P n a 21 | P 2c -2n | 33 | 3,5-diamino-4-nitropyridine N-oxide monohydrate | - C5 H8 N4 O4 - | - C5 H8 N4 O4 - | - C20 H32 N16 O16 - | 4 | 1 | QA0293 | Batsanov, Andrei S. | 3,5-Difluoro-4-nitropyridine <i>N</i>-oxide and 3,5-diamino-4-nitropyridine <i>N</i>-oxide monohydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e269 | e270 | 10.1107/S0108270100006636 | 0.71073 | MoKα | 0.042 | 0.035 | null | null | null | 0.0933 | null | null | null | null | null | 1.086 | null | null | has coordinates,has Fobs | Batsanov, Andrei S.
3,5-Difluoro-4-nitropyridine <i>N</i>-oxide and 3,5-diamino-4-nitropyridine <i>N</i>-oxide monohydrate
Acta Crystallographica Section C
56(6)
(2000)
e269-e270 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,046 | 9.0719 | 0.0002 | 18.9903 | 0.0008 | 10.1528 | 0.0003 | 90 | null | 103.62 | 0.002 | 90 | null | 1,699.92 | 0.1 | 150 | 1 | 150 | 1 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | BINAP oxide | (R)-(+)-2,2'-bis(diphenylphosphinoyl)-1,1'-binaphthyl | - C44 H32 O2 P2 - | - C44 H32 O2 P2 - | - C88 H64 O4 P4 - | 2 | 1 | QA0294 | Bunten, Kevin A.; Farrar, David H.; Lough, Alan J. | (<i>R</i>)-(+)-2,2'-Bis(diphenylphosphinoyl)-1,1'-binaphthyl | Acta Crystallographica Section C | 2,000 | 56 | 6 | e267 | e267 | 10.1107/S0108270100006508 | 0.71073 | MoKα | 0.078 | 0.052 | null | null | null | 0.099 | null | null | null | null | null | 1.021 | null | null | has coordinates,has Fobs | Bunten, Kevin A.; Farrar, David H.; Lough, Alan J.
(<i>R</i>)-(+)-2,2'-Bis(diphenylphosphinoyl)-1,1'-binaphthyl
Acta Crystallographica Section C
56(6)
(2000)
e267-e267 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,047 | 7.431 | 0.004 | 7.604 | 0.003 | 16.007 | 0.006 | 93.61 | 0.03 | 95.5 | 0.04 | 99.89 | 0.04 | 884 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | 2-hydroxy-4,6-dimethylacetophenone | 2-hydroxy-4,6-dimethylphenylethanone | - C10 H12 O2 - | - C10 H12 O2 - | - C40 H48 O8 - | 4 | 2 | QA0296 | Armelao, Lidia; Depaoli, Giovanni; Dolmella, Alessandro | 1-(2-Hydroxy-4,6-dimethylphenyl)ethanone | Acta Crystallographica Section C | 2,000 | 56 | 6 | e268 | e268 | 10.1107/S0108270100006612 | 0.71073 | MoKα | 0.11 | 0.049 | null | 0.147 | 0.126 | null | null | null | 0.913 | 1.157 | 1.157 | null | null | null | has coordinates | Armelao, Lidia; Depaoli, Giovanni; Dolmella, Alessandro
1-(2-Hydroxy-4,6-dimethylphenyl)ethanone
Acta Crystallographica Section C
56(6)
(2000)
e268-e268 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,048 | 12.19 | 0.002 | 9.147 | 0.002 | 14.612 | 0.003 | 90 | null | 104.2 | 0.02 | 90 | null | 1,579.5 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C18 H14 Cr O4 - | - C18 H14 Cr O4 - | - C72 H56 Cr4 O16 - | 4 | 1 | QA0298 | Pèpe, Gérard; Hannesschlager, Patrick; Brun, Pierre | Tricarbonyl[(6a,7,8,9,10a-η)-3,3-dimethyl-3<i>H</i>-benzo[<i>f</i>]chromene]chromium | Acta Crystallographica Section C | 2,000 | 56 | 6 | e251 | e252 | 10.1107/S0108270100006843 | 0.71073 | MoKα | 0.036 | 0.036 | null | 0.073 | null | 0.073 | null | null | 0.979 | null | null | 1.048 | null | null | has coordinates | Pèpe, Gérard; Hannesschlager, Patrick; Brun, Pierre
Tricarbonyl[(6a,7,8,9,10a-η)-3,3-dimethyl-3<i>H</i>-benzo[<i>f</i>]chromene]chromium
Acta Crystallographica Section C
56(6)
(2000)
e251-e252 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011048.cif $
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2,011,049 | 7.8786 | 0.0007 | 18.417 | 0.001 | 12.758 | 0.001 | 90 | null | 96.971 | 0.005 | 90 | null | 1,837.5 | 0.2 | 173 | 2 | 173 | 2 | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | - C22 H22 O4 - | - C22 H22 O4 - | - C88 H88 O16 - | 4 | 1 | QA0300 | Winicker, Dominik; Bolte, Michael | Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,12-<i>trans</i>-dicarboxylate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e271 | e272 | 10.1107/S0108270100006867 | 0.71073 | MoKα | 0.059 | 0.05 | null | null | null | 0.138 | null | null | null | null | null | 1.029 | null | null | has coordinates,has Fobs | Winicker, Dominik; Bolte, Michael
Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,12-<i>trans</i>-dicarboxylate
Acta Crystallographica Section C
56(6)
(2000)
e271-e272 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,050 | 10.6397 | 0.0006 | 8.2558 | 0.0005 | 13.0057 | 0.0007 | 90 | null | 90 | null | 90 | null | 1,142.41 | 0.11 | 150 | 2 | 150 | 2 | null | null | null | null | 3 | P b c a | -P 2ac 2ab | 61 | - C4 Cl2 O3 - | - C4 Cl2 O3 - | - C32 Cl16 O24 - | 8 | 1 | QA0304 | Blake, Alexander J.; Griffiths, Rhiannon M. T.; Howdle, Steven M.; Wilson, Claire | Dichloromaleic anhydride | Acta Crystallographica Section C | 2,000 | 56 | 6 | e273 | e273 | 10.1107/S0108270100007034 | 0.71073 | MoKα | 0.026 | 0.023 | null | null | null | 0.067 | null | null | null | null | null | 1.041 | null | null | has coordinates,has Fobs | Blake, Alexander J.; Griffiths, Rhiannon M. T.; Howdle, Steven M.; Wilson, Claire
Dichloromaleic anhydride
Acta Crystallographica Section C
56(6)
(2000)
e273-e273 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,051 | 6.9505 | 0.0003 | 21.882 | 0.0008 | 12.9619 | 0.0005 | 90 | null | 100.239 | 0.001 | 90 | null | 1,939.99 | 0.13 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 3-Acetyl-4-benzoyl-2-methyl-5-phenyl-3,3a-dihydropyrazolo[2,3-c]pyrimidine- 7(6H)-thione | - C22 H19 N3 O2 S - | - C22 H19 N3 O2 S - | - C88 H76 N12 O8 S4 - | 4 | 1 | QA0307 | Akkurt, Mehmet; Öztürk, Sema; Fun, Hoong-Kun; Altural, Behzat | 3-Acetyl-4-benzoyl-2-methyl-5-phenyl-3,3a-dihydropyrazolo[2,3-<i>c</i>]pyrimidine-7(6<i>H</i>)-thione | Acta Crystallographica Section C | 2,000 | 56 | 6 | e276 | e277 | 10.1107/S0108270100007241 | 0.71073 | MoKα | 0.143 | 0.061 | null | 0.152 | 0.123 | null | null | null | 0.953 | 1.107 | 1.107 | null | null | null | has coordinates,has Fobs | Akkurt, Mehmet; Öztürk, Sema; Fun, Hoong-Kun; Altural, Behzat
3-Acetyl-4-benzoyl-2-methyl-5-phenyl-3,3a-dihydropyrazolo[2,3-<i>c</i>]pyrimidine-7(6<i>H</i>)-thione
Acta Crystallographica Section C
56(6)
(2000)
e276-e277 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,052 | 12.426 | 0.003 | 29.446 | 0.01 | 7.45 | 0.009 | 90 | null | 90 | null | 90 | null | 2,726 | 3 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 21 21 2 | P 2 2ab | 18 | Dysobinin | 6β-acetoxyazadirone | - C30 H38 O6 - | - C30 H38 O6 - | - C120 H152 O24 - | 4 | 1 | QB0200 | Sarkhel, Sanjay; Jain, Girish K.; Singh, Satywan; Subramanya, Hosahalli. S.; Maulik, Prakas R. | Dysobinin, a tetranortriterpenoid | Acta Crystallographica Section C | 2,000 | 56 | 6 | e253 | e254 | 10.1107/S0108270100006041 | 0.7093 | MoKα | 0.094 | 0.045 | null | null | null | 0.127 | null | null | null | null | null | 0.971 | null | null | has coordinates,has Fobs | Sarkhel, Sanjay; Jain, Girish K.; Singh, Satywan; Subramanya, Hosahalli. S.; Maulik, Prakas R.
Dysobinin, a tetranortriterpenoid
Acta Crystallographica Section C
56(6)
(2000)
e253-e254 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,053 | 16.7683 | 0.0003 | 9.7089 | 0.0002 | 11.116 | 0.002 | 90 | null | 90.9963 | 0.0011 | 90 | null | 1,809.4 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 c 1 | C -2yc | 9 | 7-Methyl-3,7,11,17-tetraazabicyclo[11.3.1]-heptadeca-1(17),13,15-triene dihydrochloride monohydrate | - C14 H28 Cl2 N4 O - | - C14 H28 Cl2 N4 O - | - C56 H112 Cl8 N16 O4 - | 4 | 1 | QB0201 | Lodeiro, Carlos; Bastida, Rufina; Macías, Alejandro; Rodríguez, Adolfo; Saint-Maurice, Andre | Two hydrochlorides of 7-methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene | Acta Crystallographica Section C | 2,000 | 56 | 6 | e255 | e256 | 10.1107/S0108270100006065 | 0.71073 | MoKα | 0.037 | 0.035 | null | null | null | 0.112 | null | null | null | null | null | 1.096 | null | null | has coordinates,has Fobs | Lodeiro, Carlos; Bastida, Rufina; Macías, Alejandro; Rodríguez, Adolfo; Saint-Maurice, Andre
Two hydrochlorides of 7-methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene
Acta Crystallographica Section C
56(6)
(2000)
e255-e256 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
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2,011,054 | 10.7592 | 0.0003 | 10.8825 | 0.0003 | 15.4988 | 0.0003 | 90 | null | 93.9033 | 0.0013 | 90 | null | 1,810.5 | 0.08 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 7-Methyl-3,7,11,17-tetraazabicyclo[11.3.1]-heptadeca-1(17),13,15-triene trihydrochloride | - C14 H27 Cl2.826 N4.174 O0.522 - | - C14 H27 Cl2.826 N4.174 O0.522 - | - C56 H108 Cl11.304 N16.696 O2.088 - | 4 | 1 | QB0201 | Lodeiro, Carlos; Bastida, Rufina; Macías, Alejandro; Rodríguez, Adolfo; Saint-Maurice, Andre | Two hydrochlorides of 7-methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene | Acta Crystallographica Section C | 2,000 | 56 | 6 | e255 | e256 | 10.1107/S0108270100006065 | 0.71073 | MoKα | 0.117 | 0.054 | null | null | null | 0.122 | null | null | null | null | null | 0.984 | null | null | has coordinates,has disorder,has Fobs | Lodeiro, Carlos; Bastida, Rufina; Macías, Alejandro; Rodríguez, Adolfo; Saint-Maurice, Andre
Two hydrochlorides of 7-methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene
Acta Crystallographica Section C
56(6)
(2000)
e255-e256 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
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2,011,055 | 24.2211 | 0.0008 | 10.6752 | 0.0004 | 35.1913 | 0.0012 | 90 | null | 107.747 | 0.002 | 90 | null | 8,666.2 | 0.5 | 150 | 2 | 150 | 2 | null | null | null | null | 8 | P 1 21/c 1 | -P 2ybc | 14 | (Acetonitrile-N)(o-benzoquinone diimine-N,N')chloro-trans- bis(triphenylphosphine-P)ruthenium(II) hexafluorophosphate 0.25-hydrate | - C44 H39.5 Cl F6 N3 O0.25 P3 Ru - | - C44 H39 Cl F6 N3 O0.25 P3 Ru - | - C352 H312 Cl8 F48 N24 O2 P24 Ru8 - | 8 | 2 | QB0209 | Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Latorre, Ramón | (Acetonitrile-<i>N</i>)(<i>o</i>-benzoquinone diimine-<i>N</i>,<i>N</i>')chloro-<i>trans</i>-bis(triphenylphosphine-<i>P</i>)ruthenium(II) hexafluorophosphate 0.25-hydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e247 | e248 | 10.1107/S0108270100006314 | 0.71073 | MoKα | 0.165 | 0.056 | null | null | null | 0.118 | null | null | null | null | null | 0.875 | null | null | has coordinates,has Fobs | Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Latorre, Ramón
(Acetonitrile-<i>N</i>)(<i>o</i>-benzoquinone diimine-<i>N</i>,<i>N</i>')chloro-<i>trans</i>-bis(triphenylphosphine-<i>P</i>)ruthenium(II) hexafluorophosphate 0.25-hydrate
Acta Crystallographica Section C
56(6)
(2000... | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,011,056 | 12.033 | 0.002 | 12.033 | 0.002 | 13.863 | 0.004 | 90 | null | 90 | null | 120 | null | 1,738.3 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | R -3 c :H | -R 3 2"c | 167 | rinneite | tripotassium sodium hexachloroferrate(II) | - Cl6 Fe K3 Na - | - Cl6 Fe K3 Na - | - Cl36 Fe6 K18 Na6 - | 6 | 0.166667 | QB0210 | Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa | Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K | Acta Crystallographica Section C | 2,000 | 56 | 6 | e228 | e229 | 10.1107/S0108270100006053 | 0.71073 | MoKα | 0.017 | 0.017 | null | null | null | 0.031 | null | null | null | null | null | 1.623 | null | null | has coordinates,has Fobs | Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa
Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K
Acta Crystallographica Section C
56(6)
(2000)
e228-e229 | 282,532 | 2023-04-10 | 14:59:13 | #------------------------------------------------------------------------------
#$Date: 2023-04-10 17:59:09 +0300 (Mon, 10 Apr 2023) $
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2,011,057 | 11.922 | 0.001 | 11.922 | 0.001 | 13.761 | 0.002 | 90 | null | 90 | null | 120 | null | 1,693.9 | 0.3 | 84 | 2 | 84 | 2 | null | null | null | null | 4 | R -3 c :H | -R 3 2"c | 167 | rinneite | tripotassium sodium hexachloroferrate(II) | - Cl6 Fe K3 Na - | - Cl6 Fe K3 Na - | - Cl36 Fe6 K18 Na6 - | 6 | 0.166667 | QB0210 | Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa | Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K | Acta Crystallographica Section C | 2,000 | 56 | 6 | e228 | e229 | 10.1107/S0108270100006053 | 0.71073 | MoKα | 0.02 | 0.018 | null | null | null | 0.036 | null | null | null | null | null | 1.398 | null | null | has coordinates,has Fobs | Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa
Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K
Acta Crystallographica Section C
56(6)
(2000)
e228-e229 | 282,532 | 2023-04-10 | 14:59:13 | #------------------------------------------------------------------------------
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2,011,058 | 11.893 | 0.001 | 11.893 | 0.001 | 13.735 | 0.002 | 90 | null | 90 | null | 120 | null | 1,682.4 | 0.3 | 9.5 | 0.5 | 9.5 | 0.5 | null | null | null | null | 4 | R -3 c :H | -R 3 2"c | 167 | rinneite | tripotassium sodium hexachloroferrate(II) | - Cl6 Fe K3 Na - | - Cl6 Fe K3 Na - | - Cl36 Fe6 K18 Na6 - | 6 | 0.166667 | QB0210 | Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa | Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K | Acta Crystallographica Section C | 2,000 | 56 | 6 | e228 | e229 | 10.1107/S0108270100006053 | 0.71073 | MoKα | 0.02 | 0.02 | null | null | null | 0.05 | null | null | null | null | null | 1.459 | null | null | has coordinates,has Fobs | Figgis, Brian N.; Sobolev, Alexandre N.; Kucharski, Edward S.; Broughton, Vanessa
Rinneite, K~3~Na[FeCl~6~], at 293, 84 and 9.5K
Acta Crystallographica Section C
56(6)
(2000)
e228-e229 | 282,532 | 2023-04-10 | 14:59:13 | #------------------------------------------------------------------------------
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2,011,059 | 17.632 | 0.0004 | 18.284 | 0.0004 | 22.998 | 0.0004 | 90 | null | 91.27 | 0.0014 | 90 | null | 7,412.4 | 0.3 | 100 | 2 | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | - C36 H26 Cl3 Cr N6 O13 - | - C36 H24 Cl3 Cr N6 O13 - | - C288 H192 Cl24 Cr8 N48 O104 - | 8 | 1 | QB0212 | Luck, Rudy L.; Gawryszewska, Paula; Riehl, James P. | Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')chromium(III) triperchlorate hydrate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e238 | e239 | 10.1107/S0108270100006107 | 0.71073 | MoKα | null | 0.075 | null | null | null | 0.241 | null | null | null | null | null | 1.028 | null | null | has coordinates,has Fobs | Luck, Rudy L.; Gawryszewska, Paula; Riehl, James P.
Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')chromium(III) triperchlorate hydrate
Acta Crystallographica Section C
56(6)
(2000)
e238-e239 | 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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2,011,060 | 21.078 | 0.0004 | 15.0708 | 0.0004 | 15.9811 | 0.0003 | 90 | null | 102.823 | 0.001 | 90 | null | 4,949.98 | 0.19 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | Bis[copper(I)-di-1,10-phenanthroline)]terephthalate bisperchlorate | - C56 H36 Cl2 Cu2 N8 O12 - | - C56 H36 Cl2 Cu2 N8 O12 - | - C224 H144 Cl8 Cu8 N32 O48 - | 4 | 0.5 | QB0213 | Sun, Daofeng; Cao, Rong; Liang, Yucang; Hong, Maochun; Su, Weiping; Weng, Jiabao | μ-Terephthalato-bis[bis(1,10-phenanthroline)copper(I)] diperchlorate | Acta Crystallographica Section C | 2,000 | 56 | 6 | e240 | e241 | 10.1107/S0108270100006119 | 0.71073 | MoKα | 0.052 | 0.039 | null | null | null | 0.106 | null | null | null | null | null | 1.042 | null | null | has coordinates | Sun, Daofeng; Cao, Rong; Liang, Yucang; Hong, Maochun; Su, Weiping; Weng, Jiabao
μ-Terephthalato-bis[bis(1,10-phenanthroline)copper(I)] diperchlorate
Acta Crystallographica Section C
56(6)
(2000)
e240-e241 | 301,798 | 2025-08-19 | 6:41:46 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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