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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010961.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010962.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010964.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010965.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010966.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010967.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010972.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010973.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010975.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010976.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010977.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/09/2010981.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011007.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011008.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011009.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011010.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011011.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011012.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011013.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011014.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011015.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011017.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011018.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011019.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011022.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011023.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011025.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011026.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011027.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011028.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011029.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011030.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011031.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011033.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011034.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011035.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011036.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011037.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011038.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011039.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011040.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011041.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011042.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011043.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011044.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011045.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011046.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011047.cif $ #-------------------------------------------------------------------...
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 $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011049.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011050.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011051.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011052.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$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/2/01/10/2011053.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 301798 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011054.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011055.cif $ #-------------------------------------------------------------------...
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) $ #$Revision: 282532 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011056.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$Date: 2023-04-10 17:59:09 +0300 (Mon, 10 Apr 2023) $ #$Revision: 282532 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011057.cif $ #-------------------------------------------------------------------...
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
#------------------------------------------------------------------------------ #$Date: 2023-04-10 17:59:09 +0300 (Mon, 10 Apr 2023) $ #$Revision: 282532 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011058.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011059.cif $ #-------------------------------------------------------------------...
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 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/10/2011060.cif $ #-------------------------------------------------------------------...