LMucko/crystallography-open-database · Datasets at Hugging Face

2,011,760

11.1419

0.0012

20.2089

0.0014

8.7321

0.0009

90

null

110.644

0.004

90

null

1,839.9

0.3

180

2

180

2

null

4

P 1 21/c 1

-P 2ybc

14

N,N,N'-Trimethylethylenediammonium Chloride

- C10 H32 Cl4 N4 -

- C40 H128 Cl16 N16 -

4

1

GD1121

Errington, William; Somasunderam, Usha; Willey, Gerald R.

N,N,N'-Trimethylethylenediammonium dichloride

Acta Crystallographica Section C

2,001

57

2

190

191

10.1107/S0108270100016176

0.71073

MoKα

0.1244

0.0508

null

0.0962

null

0.98

null

has coordinates,has Fobs

Errington, William; Somasunderam, Usha; Willey, Gerald R. N,N,N'-Trimethylethylenediammonium dichloride Acta Crystallographica Section C 57(2) (2001) 190-191

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011760.cif $ #-------------------------------------------------------------------...

2,011,761

12.106

0.003

13.187

0.003

15.819

0.004

90

null

99.62

0.02

90

null

2,489.9

1.1

150

2

150

2

null

5

P 1 21/n 1

-P 2yn

14

(2E)-1,2-Diaza-3-phenylprop-2-enyl-tri(cyclohexyl)phosphonium chloride

- C25 H40 Cl N2 P -

- C100 H160 Cl4 N8 P4 -

4

1

GD1122

Batsanov, Andrei S.; Howard, Judith A. K.; Snowden, David G.

[(2E)-2-Benzylidenehydrazino]tricyclohexylphosphonium chloride

Acta Crystallographica Section C

2,001

57

2

195

196

10.1107/S0108270100016590

0.71073

MoKα

0.0464

0.034

null

0.0874

null

1.078

null

has coordinates

Batsanov, Andrei S.; Howard, Judith A. K.; Snowden, David G. [(2E)-2-Benzylidenehydrazino]tricyclohexylphosphonium chloride Acta Crystallographica Section C 57(2) (2001) 195-196

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011761.cif $ #-------------------------------------------------------------------...

2,011,762

5.3288

0.0003

6.3696

0.0006

18.1263

0.0009

90

null

95.811

0.004

90

null

612.09

0.07

293

2

null

4

P 1 21 1

P 2yb

4

L-Seryl-L-leucine

- C9 H18 N2 O4 -

- C18 H36 N4 O8 -

2

1

GG1024

Słowikowska, Joanna; Lipkowski, Janusz

L-Seryl-L-leucine

Acta Crystallographica Section C

2,001

57

2

187

189

10.1107/S0108270100016164

1.54178

CuKα

null

0.029

null

0.077

null

1.02

null

has coordinates,has Fobs

Słowikowska, Joanna; Lipkowski, Janusz L-Seryl-L-leucine Acta Crystallographica Section C 57(2) (2001) 187-189

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011762.cif $ #-------------------------------------------------------------------...

2,011,763

9.435

0.001

10.562

0.001

14.698

0.001

97.76

0.01

102.39

0.01

105.37

0.01

1,350.5

0.2

173

2

173

2

null

8

P -1

-P 1

2

- C27 H27 B F6 Fe N4 O0.5 P -

- C54 H54 B2 F12 Fe2 N8 O P2 -

2

1

GG1027

Ding, Li; Wagner, Matthias; Bolte, Michael

Pseudopolymorphism of [2,5-bis(2-pyridyl)pyrazine]ferrocenyl(methyl)boron hexafluorophosphate

Acta Crystallographica Section C

2,001

57

2

162

164

10.1107/S0108270100017741

0.71073

MoKα

0.128

0.08

null

0.203

null

1.08

null

has coordinates,has disorder,has Fobs

Ding, Li; Wagner, Matthias; Bolte, Michael Pseudopolymorphism of [2,5-bis(2-pyridyl)pyrazine]ferrocenyl(methyl)boron hexafluorophosphate Acta Crystallographica Section C 57(2) (2001) 162-164

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/2/01/17/2011763.cif $ #-------------------------------------------------------------------...

2,011,764

8.011

0.001

16.63

0.001

20.384

0.001

98.55

0.01

99.47

0.01

92.03

0.01

2,643.8

0.4

173

2

173

2

null

7

P -1

-P 1

2

- C26 H23.5 B F6 Fe N4.5 P -

- C104 H94 B4 F24 Fe4 N18 P4 -

4

2

GG1027

Ding, Li; Wagner, Matthias; Bolte, Michael

Pseudopolymorphism of [2,5-bis(2-pyridyl)pyrazine]ferrocenyl(methyl)boron hexafluorophosphate

Acta Crystallographica Section C

2,001

57

2

162

164

10.1107/S0108270100017741

0.71073

MoKα

0.153

0.076

null

0.138

null

1.08

null

has coordinates,has disorder,has Fobs

Ding, Li; Wagner, Matthias; Bolte, Michael Pseudopolymorphism of [2,5-bis(2-pyridyl)pyrazine]ferrocenyl(methyl)boron hexafluorophosphate Acta Crystallographica Section C 57(2) (2001) 162-164

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/2/01/17/2011764.cif $ #-------------------------------------------------------------------...

2,011,765

29.207

0.002

6.586

0.0004

7.4782

0.0004

90

null

90

null

90

null

1,438.49

0.15

150

1

150

1

null

4

P n m a

-P 2ac 2n

62

4-(1-Adamantylamino)-2-amino-6-methoxy-5-nitrosopyrimidine

- C15 H21 N5 O2 -

- C60 H84 N20 O8 -

4

0.5

GG1029

Low, John Nicolson; Marchal, Antonio; Nogueras, Manuel; Melguizo, Manuel; Sánchez, Adolfo

4-(1-Adamantylamino)-2-amino-6-methoxy-5-nitrosopyrimidine

Acta Crystallographica Section C

2,001

57

2

178

179

10.1107/S0108270100015754

0.71073

MoKα

0.146

0.06

null

0.181

null

0.91

null

has coordinates,has Fobs

Low, John Nicolson; Marchal, Antonio; Nogueras, Manuel; Melguizo, Manuel; Sánchez, Adolfo 4-(1-Adamantylamino)-2-amino-6-methoxy-5-nitrosopyrimidine Acta Crystallographica Section C 57(2) (2001) 178-179

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/2/01/17/2011765.cif $ #-------------------------------------------------------------------...

2,011,766

10.16

0.0005

18.4257

0.001

22.643

0.0013

90

null

109.808

0.005

90

null

3,988.1

0.4

150

2

150

2

null

6

P 1 21/c 1

-P 2ybc

14

cis-Bis[N^1^,N^2^-bis(trimethylsilyl)benzamidinato-κ^2^N^1^N^2^]-chloro- (4-tolylimido-κN)-vanadium(V)

- C33 H53 Cl N5 Si4 V -

- C132 H212 Cl4 N20 Si16 V4 -

4

1

GG1031

Ellis, Dianne D.; Spek, Anthony L.

cis-Bis[N^1^,N^2^-bis(trimethylsilyl)benzamidinato-κ^2^N^1^,N^2^]chloro(4-tolylimido-κN)vanadium(V)

Acta Crystallographica Section C

2,001

57

2

147

148

10.1107/S010827010001564X

0.71073

MoKα

0.102

0.052

null

0.108

null

0.99

null

has coordinates,has Fobs

Ellis, Dianne D.; Spek, Anthony L. cis-Bis[N^1^,N^2^-bis(trimethylsilyl)benzamidinato-κ^2^N^1^,N^2^]chloro(4-tolylimido-κN)vanadium(V) Acta Crystallographica Section C 57(2) (2001) 147-148

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/2/01/17/2011766.cif $ #-------------------------------------------------------------------...

2,011,767

5.7537

0.0004

5.7537

0.0004

48.108

0.004

90

null

90

null

120

null

1,379.25

0.18

293

2

293

2

null

6

R -3 c :H

-R 3 2"c

167

- Al Br0.478 Ca2 Cl0.522 H10 O8 -

- Al Br0.478 Ca2 Cl0.522 H10.0002 O8 -

- Al6 Br2.868 Ca12 Cl3.132 H60.0012 O48 -

6

0.166667

IZ1005

Rapin, Jean-Philippe; François, Michel

The double-layered hydroxide 3CaO·Al~2~O~3~·0.5CaBr~2~·0.5CaCl~2~·10H~2~O

Acta Crystallographica Section C

2,001

57

2

137

138

10.1107/S0108270100014025

0.71073

MoKα

0.0585

0.0381

null

0.0901

null

1.05

null

has coordinates,has Fobs

Rapin, Jean-Philippe; François, Michel The double-layered hydroxide 3CaO·Al~2~O~3~·0.5CaBr~2~·0.5CaCl~2~·10H~2~O Acta Crystallographica Section C 57(2) (2001) 137-138

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/2/01/17/2011767.cif $ #-------------------------------------------------------------------...

2,011,768

6.6296

0.0001

16.3605

0.0002

14.6386

0.0002

90

null

99.938

0.001

90

null

1,563.93

0.04

293

2

293

2

null

7

P 1 21/n 1

-P 2yn

14

Trans-bis(aminopyridine)-bis(O,O'-diisopropyl dithiophosphato-S,S')nickel(II)

- C22 H40 N4 Ni O4 P2 S4 -

- C44 H80 N8 Ni2 O8 P4 S8 -

2

0.5

LN1110

Hao, Qingli; Jian, Fangfang; Wang, Xin; Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun

trans-Bis(2-aminopyridine-N)bis(O,O'-diisopropyl dithiophosphato-S,S')nickel(II)

Acta Crystallographica Section C

2,001

57

2

160

161

10.1107/S0108270100016073

0.71073

MoKα

0.041

0.035

null

0.087

null

0.97

null

has coordinates,has Fobs

Hao, Qingli; Jian, Fangfang; Wang, Xin; Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun trans-Bis(2-aminopyridine-N)bis(O,O'-diisopropyl dithiophosphato-S,S')nickel(II) Acta Crystallographica Section C 57(2) (2001) 160-161

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/2/01/17/2011768.cif $ #-------------------------------------------------------------------...

2,011,769

12.346

0.002

5.567

0.001

22.578

0.006

90

null

95.2

0.01

90

null

1,545.4

0.6

293

2

293

2

null

4

P 1 21/c 1

-P 2ybc

14

N,N'-(1,2-phenylene)bis(pyridine-2-carboxamide)

- C18 H14 N4 O2 -

- C72 H56 N16 O8 -

4

1

NA1486

Lin, Jun; Zhang, Jun-Yong; Xu, Yan; Ke, Xiao-Kang; Guo, Zijian

N,N'-(1,2-phenylene)bis(pyridine-2-carboxamide) and N,N'-(1,2-cyclohexanediyl)bis(pyridine-2-carboxamide) toluene hemisolvate

Acta Crystallographica Section C

2,001

57

2

192

194

10.1107/S0108270100016395

0.71073

MoKα

0.104

0.053

null

0.139

null

1.031

null

has coordinates,has Fobs

Lin, Jun; Zhang, Jun-Yong; Xu, Yan; Ke, Xiao-Kang; Guo, Zijian N,N'-(1,2-phenylene)bis(pyridine-2-carboxamide) and N,N'-(1,2-cyclohexanediyl)bis(pyridine-2-carboxamide) toluene hemisolvate Acta Crystallographica Section C 57(2) (2001) 192-194

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011769.cif $ #-------------------------------------------------------------------...

2,011,770

9.899

0.002

10.492

0.002

10.795

0.002

88.52

0.03

64.39

0.03

89.7

0.03

1,010.7

0.4

293

2

293

2

null

4

P -1

-P 1

2

N,N'-(1,2-cyclohexanediyl)bis(pyridine-2-carboxamide)

- C21.5 H24 N4 O2 -

- C21.5 H20 N4 O2 -

- C43 H40 N8 O4 -

2

1

NA1486

Lin, Jun; Zhang, Jun-Yong; Xu, Yan; Ke, Xiao-Kang; Guo, Zijian

N,N'-(1,2-phenylene)bis(pyridine-2-carboxamide) and N,N'-(1,2-cyclohexanediyl)bis(pyridine-2-carboxamide) toluene hemisolvate

Acta Crystallographica Section C

2,001

57

2

192

194

10.1107/S0108270100016395

0.71073

MoKα

0.072

0.049

null

0.173

null

1.062

null

has coordinates,has disorder,has Fobs

Lin, Jun; Zhang, Jun-Yong; Xu, Yan; Ke, Xiao-Kang; Guo, Zijian N,N'-(1,2-phenylene)bis(pyridine-2-carboxamide) and N,N'-(1,2-cyclohexanediyl)bis(pyridine-2-carboxamide) toluene hemisolvate Acta Crystallographica Section C 57(2) (2001) 192-194

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/2/01/17/2011770.cif $ #-------------------------------------------------------------------...

2,011,771

8.447

0.0006

12.91

0.0012

12.985

0.0013

90

null

105.27

0.006

90

null

1,366

0.2

123

2

123

2

null

5

P 1 21 1

P 2yb

4

Dichloro[N,N,N',N'-tetrakis(2-pyridylmethyl)benzene-1,4-diamine]iron(II)

- C30 H28 Cl2 Fe N6 -

- C60 H56 Cl4 Fe2 N12 -

2

1

NA1490

Batten, Stuart R.; McKenzie, Christine J.; Preuss Nielsen, Lars

Dichloro[N,N,N',N'-tetrakis(2-pyridylmethyl)benzene-1,4-diamine]iron(II)

Acta Crystallographica Section C

2,001

57

2

156

157

10.1107/S010827010001684X

0.71073

MoKα

0.1323

0.0796

null

0.1558

null

1.061

null

has coordinates

Batten, Stuart R.; McKenzie, Christine J.; Preuss Nielsen, Lars Dichloro[N,N,N',N'-tetrakis(2-pyridylmethyl)benzene-1,4-diamine]iron(II) Acta Crystallographica Section C 57(2) (2001) 156-157

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/2/01/17/2011771.cif $ #-------------------------------------------------------------------...

2,011,772

17.4297

0.0008

17.4297

0.0008

4.1754

0.0003

90

null

90

null

90

null

1,268.46

0.12

293

2

293

2

null

6

I -4

82

Tetrathioureamercury(II) tetrathiocyanatomanganate(II)

- C8 H16 Hg Mn N12 S8 -

- C16 H32 Hg2 Mn2 N24 S16 -

2

0.25

SK1404

Yu, Wen Tao; Wang, Xin Qiang; Xu, Dong; Lu, Meng Kai; Yuan, Duo Rong

Tetrathioureamercury(II) tetrathiocyanatomanganate(II)

Acta Crystallographica Section C

2,001

57

2

145

146

10.1107/S0108270100015651

0.71073

MoKα

0.035

0.033

null

0.08

null

1.051

null

has coordinates,has Fobs

Yu, Wen Tao; Wang, Xin Qiang; Xu, Dong; Lu, Meng Kai; Yuan, Duo Rong Tetrathioureamercury(II) tetrathiocyanatomanganate(II) Acta Crystallographica Section C 57(2) (2001) 145-146

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/2/01/17/2011772.cif $ #-------------------------------------------------------------------...

2,011,773

4.5541

0.0002

16.314

0.0008

17.5245

0.0009

90

null

96.234

0.002

90

null

1,294.29

0.11

293

2

293

2

null

4

C 1 c 1

C -2yc

9

4-[1H-Benzimidazolium]-Benzene Carbonic Acid dihydrate solvate

- C14 H14 N2 O4 -

- C56 H56 N8 O16 -

4

1

SK1423

Jian, Fangfang; Bei, Fengli; Yang, Xujie; Lu, Lude; Wang, Xin; Abdul Razak, Ibrahim; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun

4-(1H-Benzimidazol-3-ium-2-yl)benzoate dihydrate

Acta Crystallographica Section C

2,001

57

2

176

177

10.1107/S0108270100015675

0.71073

MoKα

0.06

0.045

null

0.111

null

0.97

null

has coordinates,has Fobs

Jian, Fangfang; Bei, Fengli; Yang, Xujie; Lu, Lude; Wang, Xin; Abdul Razak, Ibrahim; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun 4-(1H-Benzimidazol-3-ium-2-yl)benzoate dihydrate Acta Crystallographica Section C 57(2) (2001) 176-177

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011773.cif $ #-------------------------------------------------------------------...

2,011,774

7.3772

0.0014

20.063

0.003

10.4576

0.0012

90

null

90.513

0.012

90

null

1,547.8

0.4

143

2

143

2

null

4

P 1 21 1

P 2yb

4

dimethyl (1R,8R)-1,11,11-trimethyl-2,3-diazatricyclo[6.2.1.0^2,6^]undecan-3,5- dien-4,5-dicarboxylate

- C16 H22 N2 O4 -

- C64 H88 N8 O16 -

4

2

SK1429

Bats, Jan W.; Grundl, Marc A.; Hashmi, A. Stephen K.

Dimethyl (1R,8R)-1,11,11-trimethyl-2,3-diazatricyclo[6.2.1.0^2,6^]undeca-3,5-diene-4,5-dicarboxylate, a chiral molecule with an approximate centrosymmetric crystal structure

Acta Crystallographica Section C

2,001

57

2

208

210

10.1107/S0108270100017960

0.71073

MoKα

0.0393

0.0359

null

0.0959

null

1.079

null

has coordinates,has Fobs

Bats, Jan W.; Grundl, Marc A.; Hashmi, A. Stephen K. Dimethyl (1R,8R)-1,11,11-trimethyl-2,3-diazatricyclo[6.2.1.0^2,6^]undeca-3,5-diene-4,5-dicarboxylate, a chiral molecule with an approximate centrosymmetric crystal structure Acta Crystallographica Section C 57(2) (2001) 208-210

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011774.cif $ #-------------------------------------------------------------------...

2,011,775

7.8329

0.0015

7.99

0.002

12.369

0.003

79.766

0.017

81.257

0.019

69.646

0.008

710.8

0.3

150

2

150

2

null

4

P -1

-P 1

2

4-Methyl-2-nitroaniline

- C7 H8 N2 O2 -

- C28 H32 N8 O8 -

4

2

SK1437

Cannon, Debbie; Glidewell, Christopher; Low, John N.; Quesada, Antonio; Wardell, James L.

Hydrogen bonding in C-methylated nitroanilines: three triclinic examples with Z' = 2 or 4

Acta Crystallographica Section C

2,001

57

2

216

221

10.1107/S0108270100017984

0.71073

MoKα

0.244

0.071

null

0.174

null

0.833

null

has coordinates,has Fobs

Cannon, Debbie; Glidewell, Christopher; Low, John N.; Quesada, Antonio; Wardell, James L. Hydrogen bonding in C-methylated nitroanilines: three triclinic examples with Z' = 2 or 4 Acta Crystallographica Section C 57(2) (2001) 216-221

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/2/01/17/2011775.cif $ #-------------------------------------------------------------------...

2,011,776

7.1422

0.0014

7.4564

0.0015

17.044

0.003

81.43

0.03

89.27

0.03

61.84

0.03

789.6

0.4

150

2

150

2

null

4

P -1

-P 1

2

4,5-Dimethyl-2-nitroaniline

- C8 H10 N2 O2 -

- C32 H40 N8 O8 -

4

2

SK1437

Cannon, Debbie; Glidewell, Christopher; Low, John N.; Quesada, Antonio; Wardell, James L.

Hydrogen bonding in C-methylated nitroanilines: three triclinic examples with Z' = 2 or 4

Acta Crystallographica Section C

2,001

57

2

216

221

10.1107/S0108270100017984

0.71073

MoKα

0.115

0.057

null

0.159

null

0.958

null

has coordinates,has Fobs

Cannon, Debbie; Glidewell, Christopher; Low, John N.; Quesada, Antonio; Wardell, James L. Hydrogen bonding in C-methylated nitroanilines: three triclinic examples with Z' = 2 or 4 Acta Crystallographica Section C 57(2) (2001) 216-221

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011776.cif $ #-------------------------------------------------------------------...

2,011,777

7.3814

0.0002

8.2085

0.0003

23.5355

0.0009

87.931

0.0013

89.888

0.0012

88.371

0.002

1,424.51

0.08

150

2

150

2

null

4

P -1

-P 1

2

4-Methyl-3-nitroaniline

- C7 H8 N2 O2 -

- C56 H64 N16 O16 -

8

4

SK1437

Cannon, Debbie; Glidewell, Christopher; Low, John N.; Quesada, Antonio; Wardell, James L.

Hydrogen bonding in C-methylated nitroanilines: three triclinic examples with Z' = 2 or 4

Acta Crystallographica Section C

2,001

57

2

216

221

10.1107/S0108270100017984

0.71073

MoKα

0.14

0.063

null

0.191

null

0.969

null

has coordinates,has Fobs

Cannon, Debbie; Glidewell, Christopher; Low, John N.; Quesada, Antonio; Wardell, James L. Hydrogen bonding in C-methylated nitroanilines: three triclinic examples with Z' = 2 or 4 Acta Crystallographica Section C 57(2) (2001) 216-221

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011777.cif $ #-------------------------------------------------------------------...

2,011,778

11.7729

0.0007

5.5841

0.0004

24.549

0.003

90

null

97.52

0.007

90

null

1,600

0.2

293

2

293

2

null

4

P 1 21/c 1

-P 2ybc

14

betaine-betainium hydrogen oxalate

N,N,N-trimethylglycine-N,N,N-trimethylglycinium-hydrogenoxalate

- C12 H24 N2 O8 -

- C48 H96 N8 O32 -

4

1

SK1441

Rodrigues, V. H.; Paixão, J. A.; Costa, M.M.R.R.; Matos Beja, A.

Betaine betainium hydrogen oxalate

Acta Crystallographica Section C

2,001

57

2

213

215

10.1107/S0108270100019193

0.71073

MoKα

0.1157

0.0435

null

0.1368

null

1.003

null

has coordinates,has Fobs

Rodrigues, V. H.; Paixão, J. A.; Costa, M.M.R.R.; Matos Beja, A. Betaine betainium hydrogen oxalate Acta Crystallographica Section C 57(2) (2001) 213-215

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/2/01/17/2011778.cif $ #-------------------------------------------------------------------...

2,011,779

5.0038

0.0015

6.442

0.002

8.3179

0.0011

78.6

0.02

80.62

0.02

79.8

0.02

256.39

0.12

293

2

293

2

null

4

P 1

1

sarcosinium tartrate

- C7 H13 N O8 -

1

VJ1116

Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.

Sarcosinium tartrate

Acta Crystallographica Section C

2,001

57

2

165

166

10.1107/S0108270100012440

0.71073

Mokα

0.025

null

0.066

null

1.089

null

has coordinates

Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S. Sarcosinium tartrate Acta Crystallographica Section C 57(2) (2001) 165-166

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011779.cif $ #-------------------------------------------------------------------...

2,011,780

16.996

0.002

8.1356

0.0011

20.66

0.003

90

null

90

null

90

null

2,856.7

0.7

298

2

null

3

P n a 21

P 2c -2n

33

6,7-dicyano-2,3-di(2-pyridyl) pyrazine

- C16 H8 N6 -

- C128 H64 N48 -

8

2

VJ1118

Du, Miao; Bu, Xian-He; Liu, He; Leng, Xue-Bing

5,6-Bis(2-pyridyl)-2,3-pyrazinedicarbonitrile

Acta Crystallographica Section C

2,001

57

2

201

202

10.1107/S0108270100017625

0.71073

MoKα

null

0.0367

null

0.1013

null

0.983

null

has coordinates,has Fobs

Du, Miao; Bu, Xian-He; Liu, He; Leng, Xue-Bing 5,6-Bis(2-pyridyl)-2,3-pyrazinedicarbonitrile Acta Crystallographica Section C 57(2) (2001) 201-202

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011780.cif $ #-------------------------------------------------------------------...

2,011,781

7.6207

0.0004

9.5869

0.0005

10.6829

0.0005

71.115

0.003

84.066

0.003

67.921

0.002

684.16

0.06

293

2

293

2

null

5

P -1

-P 1

2

acridine-trichlorogold(III)

(acridine-N)trichlorogold(III)

- C13 H9 Au Cl3 N -

- C26 H18 Au2 Cl6 N2 -

2

1

AV1055

Sloufova, Ivana; Slouf, Miroslav

(Acridine-N)trichlorogold(III)

Acta Crystallographica Section C

2,001

57

3

248

249

10.1107/S0108270100018151

0.71073

MoKα

0.028

0.025

null

0.059

null

1.094

null

has coordinates,has Fobs

Sloufova, Ivana; Slouf, Miroslav (Acridine-N)trichlorogold(III) Acta Crystallographica Section C 57(3) (2001) 248-249

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/2/01/17/2011781.cif $ #-------------------------------------------------------------------...

2,011,782

10.2144

0.0007

18.018

0.001

13.1304

0.0009

90

null

90.177

0.001

90

null

2,416.5

0.3

120

null

120

null

6

P 1 21 1

P 2yb

4

- C39 H86 N O5 P Sn3 -

- C78 H172 N2 O10 P2 Sn6 -

2

1

AV1061

Khoo, Lian Ee; Hazell, Alan

Polymeric [μ~3~-(N-phosphonomethyl)glycinato]tris(tri-n-butyltin)

Acta Crystallographica Section C

2,001

57

3

254

256

10.1107/S0108270100018898

0.71073

MoKα

null

0.029

null

0.071

null

1.122

null

has coordinates

Khoo, Lian Ee; Hazell, Alan Polymeric [μ~3~-(N-phosphonomethyl)glycinato]tris(tri-n-butyltin) Acta Crystallographica Section C 57(3) (2001) 254-256

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/2/01/17/2011782.cif $ #-------------------------------------------------------------------...

2,011,783

8.141

0.002

13.7976

0.0016

21.852

0.002

90

null

90

null

90

null

2,454.6

0.7

293

2

293

2

null

4

P 21 21 21

P 2ac 2ab

19

- C26 H26 Br2 O5 -

- C104 H104 Br8 O20 -

4

1

BJ1007

Sim, Wonbo; Lee, Jai Young; Kim, Jong Seung; Kim, Jin-Gyu; Suh, Il-Hwan

6,7-Bis(bromomethyl)-2,11,18,21,24-pentaoxatetracyclo[23.4.0.0^4,9^.0^12,17^]nonacosa-1(25),4(9),5,7,12(17),13,15,26,28-nonaene

Acta Crystallographica Section C

2,001

57

3

293

294

10.1107/S0108270100018473

0.71073

MoKα

0.1832

0.0641

null

0.1232

null

1.011

null

has coordinates,has disorder,has Fobs

Sim, Wonbo; Lee, Jai Young; Kim, Jong Seung; Kim, Jin-Gyu; Suh, Il-Hwan 6,7-Bis(bromomethyl)-2,11,18,21,24-pentaoxatetracyclo[23.4.0.0^4,9^.0^12,17^]nonacosa-1(25),4(9),5,7,12(17),13,15,26,28-nonaene Acta Crystallographica Section C 57(3) (2001) 293-294

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011783.cif $ #-------------------------------------------------------------------...

2,011,784

10.4971

0.0001

15.5281

0.0002

16.393

0.0002

90

null

101.51

0.01

90

null

2,618.32

0.11

223

2

223

2

null

6

C 1 c 1

C -2yc

9

[Ethylene-1,2-bis(diphenylphosphine)-P,P']dinitratoplatinum(II)

- C26 H24 N2 O6 P2 Pt -

- C104 H96 N8 O24 P8 Pt4 -

4

1

BK1556

Arendse, Malcolm J.; Anderson, Gordon K.; Rath, Nigam P.

[Ethylene-1,2-bis(diphenylphosphine)-P,P']dinitratoplatinum(II) and cis-bis[(diphenylphosphinomethyl)diphenylphosphine oxide-O,P]platinum(II) dinitrate dihydrate

Acta Crystallographica Section C

2,001

57

3

237

239

10.1107/S0108270100017273

0.71073

MoKα

0.058

0.039

null

0.069

null

1.03

null

has coordinates,has Fobs

Arendse, Malcolm J.; Anderson, Gordon K.; Rath, Nigam P. [Ethylene-1,2-bis(diphenylphosphine)-P,P']dinitratoplatinum(II) and cis-bis[(diphenylphosphinomethyl)diphenylphosphine oxide-O,P]platinum(II) dinitrate dihydrate Acta Crystallographica Section C 57(3) (2001) 237-239

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011784.cif $ #-------------------------------------------------------------------...

2,011,785

12.9843

0.0002

16.3998

0.0002

22.6979

0.0003

90

null

92.81

0.01

90

null

4,827.48

0.12

213

2

213

2

null

6

P 1 21/n 1

-P 2yn

14

cis-[Bis(diphenylphosphinomethyl)diphenylphosphine oxide-O,P]platinum(II) dinitrate dihydrate

- C50 H48 N2 O10 P4 Pt -

- C200 H192 N8 O40 P16 Pt4 -

4

1

BK1556

Arendse, Malcolm J.; Anderson, Gordon K.; Rath, Nigam P.

[Ethylene-1,2-bis(diphenylphosphine)-P,P']dinitratoplatinum(II) and cis-bis[(diphenylphosphinomethyl)diphenylphosphine oxide-O,P]platinum(II) dinitrate dihydrate

Acta Crystallographica Section C

2,001

57

3

237

239

10.1107/S0108270100017273

0.71073

MoKα

0.049

0.031

null

0.069

null

1.09

null

has coordinates,has Fobs

Arendse, Malcolm J.; Anderson, Gordon K.; Rath, Nigam P. [Ethylene-1,2-bis(diphenylphosphine)-P,P']dinitratoplatinum(II) and cis-bis[(diphenylphosphinomethyl)diphenylphosphine oxide-O,P]platinum(II) dinitrate dihydrate Acta Crystallographica Section C 57(3) (2001) 237-239

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/2/01/17/2011785.cif $ #-------------------------------------------------------------------...

2,011,786

9.2351

0.0007

11.607

0.001

13.807

0.001

77.891

0.001

81.46

0.01

69.14

0.01

1,347.8

0.2

293

2

293

2

null

7

P -1

-P 1

2

bis(tetraphenylphosphonium) dioxobis(pyridine-2,6-dicarbothioate-O,N,O')uranium(VI)

- C62 H46 N2 O6 P2 S4 U -

1

0.5

BK1565

Neu, Mary P.; Johnson, Mitchell T.; Matonic, John H.; Scott, Brian L.

Actinide interactions with microbial chelators: the dioxobis[pyridine-2,6-bis(monothiocarboxylato)]uranium(VI) ion

Acta Crystallographica Section C

2,001

57

3

240

242

10.1107/S0108270100017285

0.71073

MoKα

0.032

0.03

null

0.073

null

1.04

null

has coordinates

Neu, Mary P.; Johnson, Mitchell T.; Matonic, John H.; Scott, Brian L. Actinide interactions with microbial chelators: the dioxobis[pyridine-2,6-bis(monothiocarboxylato)]uranium(VI) ion Acta Crystallographica Section C 57(3) (2001) 240-242

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011786.cif $ #-------------------------------------------------------------------...

2,011,787

11.7469

0.0001

18.2581

0.0002

14.5558

0.0001

90

null

101.352

0.001

90

null

3,060.8

0.05

150

2

150

2

null

7

P 1 21/n 1

-P 2yn

14

- C19 H48 B9 Br Mn N O3 -

- C19 H44.29 B9 Br Mn N O3 -

- C76 H177.16 B36 Br4 Mn4 N4 O12 -

4

1

BK1569

Kennedy, Alan R.; Morris, John H.

A nido-6-manganadecaborane salt

Acta Crystallographica Section C

2,001

57

3

269

270

10.1107/S0108270100019843

0.71073

MoKα

0.0742

0.0488

null

0.1431

null

1.03

null

has coordinates,has disorder,has Fobs

Kennedy, Alan R.; Morris, John H. A nido-6-manganadecaborane salt Acta Crystallographica Section C 57(3) (2001) 269-270

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/2/01/17/2011787.cif $ #-------------------------------------------------------------------...

2,011,788

11.0346

0.0005

8.8957

0.0004

11.4161

0.0005

90

null

103.946

0.001

90

null

1,087.58

0.08

298

2

298

2

null

6

P 1 21/c 1

-P 2ybc

14

trans-bis(ethanolamine)bis(saccharinato)copper(II)

- C18 H22 Cu N4 O8 S2 -

- C36 H44 Cu2 N8 O16 S4 -

2

0.5

BM1435

Yilmaz, Veysel T.; Andac, Omer; Topcu, Yildiray; Harrison, William T. A.

trans-Bis(ethanolamine-N,O)bis(saccharinato-N)copper(II)

Acta Crystallographica Section C

2,001

57

3

271

272

10.1107/S0108270100019867

0.71073

MoKα

0.043

0.033

null

0.099

null

1.04

null

has coordinates,has Fobs

Yilmaz, Veysel T.; Andac, Omer; Topcu, Yildiray; Harrison, William T. A. trans-Bis(ethanolamine-N,O)bis(saccharinato-N)copper(II) Acta Crystallographica Section C 57(3) (2001) 271-272

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011788.cif $ #-------------------------------------------------------------------...

2,011,789

7.4692

0.0005

8.7343

0.0007

8.909

0.0007

68.104

0.004

77.038

0.004

67.31

0.004

495.34

0.07

150

2

150

2

null

4

P -1

-P 1

2

3-Methyl-4-(dibromomethyl)methoxybenzene

- C9 H10 Br2 O -

- C18 H20 Br4 O2 -

2

1

BM1445

Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.

1-(Dibromomethyl)-4-methoxy-2-methylbenzene

Acta Crystallographica Section C

2,001

57

3

317

318

10.1107/S0108270100019375

0.71073

MoKα

0.0676

0.0452

null

0.109

null

1.013

null

has coordinates

Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A. 1-(Dibromomethyl)-4-methoxy-2-methylbenzene Acta Crystallographica Section C 57(3) (2001) 317-318

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011789.cif $ #-------------------------------------------------------------------...

2,011,790

26.12

0.005

18.473

0.004

10.379

0.003

90

null

90

null

90

null

5,008

2

293

2

293

2

null

3

P b c a

-P 2ac 2ab

61

C.I. Solvent Yellow 4

4-(phenyldiazenyl)naphthalen-1-amine

- C16 H13 N3 -

- C256 H208 N48 -

16

2

BR1305

Yatsenko, A. V.; Chernyshev, V. V.; Paseshnichenko, K. A.; Schenk, H.

4-(Phenyldiazenyl)naphthalen-1-amine and its hydrochloride

Acta Crystallographica Section C

2,001

57

3

295

297

10.1107/S0108270100018692

0.71073

MoKα

0.105

0.053

null

0.118

null

1.282

null

has coordinates,has Fobs

Yatsenko, A. V.; Chernyshev, V. V.; Paseshnichenko, K. A.; Schenk, H. 4-(Phenyldiazenyl)naphthalen-1-amine and its hydrochloride Acta Crystallographica Section C 57(3) (2001) 295-297

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011790.cif $ #-------------------------------------------------------------------...

2,011,791

7.426

0.003

13.305

0.004

14.027

0.004

90

null

95.32

0.02

90

null

1,379.9

0.8

295

2

295

2

null

4

P 1 21/c 1

-P 2ybc

14

[4-(phenyldiazenyl)naphthalen-1-yl]ammonium chloride

- C16 H14 Cl N3 -

- C64 H56 Cl4 N12 -

4

1

BR1305

Yatsenko, A. V.; Chernyshev, V. V.; Paseshnichenko, K. A.; Schenk, H.

4-(Phenyldiazenyl)naphthalen-1-amine and its hydrochloride

Acta Crystallographica Section C

2,001

57

3

295

297

10.1107/S0108270100018692

1.5418

CuKα

null

1.6

null

has coordinates

Yatsenko, A. V.; Chernyshev, V. V.; Paseshnichenko, K. A.; Schenk, H. 4-(Phenyldiazenyl)naphthalen-1-amine and its hydrochloride Acta Crystallographica Section C 57(3) (2001) 295-297

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011791.cif $ #-------------------------------------------------------------------...

2,011,792

23.534

0.0005

23.534

0.0005

23.534

0.0005

90

null

90

null

90

null

13,034.3

0.5

293

1

293

1

null

3

P a -3

-P 2ac 2ab 3

205

- O7 P2 Ti -

- O756 P216 Ti108 -

108

4.5

BR1307

Norberg, Stefan T.; Svennson, Göran; Albertsson, Jörgen

A TiP~2~O~7~ superstructure

Acta Crystallographica Section C

2,001

57

3

225

227

10.1107/S0108270100018709

0.8522

synchrotronx-rayverticalwiggler

0.048

0.046

null

0.059

null

0.059

null

2.779

null

2.872

null

has coordinates

Norberg, Stefan T.; Svennson, Göran; Albertsson, Jörgen A TiP~2~O~7~ superstructure Acta Crystallographica Section C 57(3) (2001) 225-227

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/2/01/17/2011792.cif $ #-------------------------------------------------------------------...

2,011,793

5.164

0.0006

5.4013

0.0007

9.2982

0.0011

90

null

96.596

0.002

90

null

257.63

0.05

293

2

293

2

null

4

P 1 21/n 1

-P 2yn

14

Lithium tin hydroxide

Dilithium tin(VI) hexahydroxide

- H6 Li2 O6 Sn -

- H12 Li4 O12 Sn2 -

2

0.5

BR1309

Yang, Shoufeng; Zavalij, Peter Y.; Whittingham, M. Stanley

Li~2~Sn(OH)~6~

Acta Crystallographica Section C

2,001

57

3

228

229

10.1107/S0108270100018710

0.71073

MoKα

0.019

0.017

null

0.041

null

1.058

null

has coordinates,has Fobs

Yang, Shoufeng; Zavalij, Peter Y.; Whittingham, M. Stanley Li~2~Sn(OH)~6~ Acta Crystallographica Section C 57(3) (2001) 228-229

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011793.cif $ #-------------------------------------------------------------------...

2,011,794

6.337

0.001

8.028

0.001

12.169

0.002

80.53

0.01

84.12

0.01

85.4

0.01

606.16

0.16

183

null

4

P -1

-P 1

2

- C10 H23 N O4 -

- C20 H46 N2 O8 -

2

1

DE1162

Wiebcke, Michael; Felsche, Jürgen

Benzyltrimethylammonium hydroxide trihydrate containing hydroxide–water layers

Acta Crystallographica Section C

2,001

57

3

306

308

10.1107/S0108270100019363

0.71073

MoKα

null

0.0553

null

0.1613

null

1.013

null

has coordinates,has Fobs

Wiebcke, Michael; Felsche, Jürgen Benzyltrimethylammonium hydroxide trihydrate containing hydroxide–water layers Acta Crystallographica Section C 57(3) (2001) 306-308

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011794.cif $ #-------------------------------------------------------------------...

2,011,795

7.334

0.004

10.791

0.006

11.543

0.007

69.7

0.02

75.01

0.02

86.653

0.015

827.1

0.8

156

null

156

2

null

4

P -1

-P 1

2

3,3'-(1,2-Ethynediyl)bis-2(1H)-pyridinone (I) and 6,6'-(1,2-Ethynediyl)bis-2(1H)-pyridinone

- C12.66667 H10.66667 N2 O2.66667 -

- C12.6667 H10.6667 N2 O2.66667 -

- C38 H32 N6 O8 -

3

1.5

FR1297

Maverick, Emily F.; Wash, Paul L.; Lightner, David A.

A hydrogen-bonded `trimer' of two symmetric dipyridones

Acta Crystallographica Section C

2,001

57

3

284

285

10.1107/S0108270100015523

0.7107

MoKα

0.134

0.051

null

0.176

null

1.079

null

has coordinates

Maverick, Emily F.; Wash, Paul L.; Lightner, David A. A hydrogen-bonded `trimer' of two symmetric dipyridones Acta Crystallographica Section C 57(3) (2001) 284-285

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011795.cif $ #-------------------------------------------------------------------...

2,011,796

14.178

0.003

6.3433

0.0006

19.227

0.003

90

null

101.538

0.015

90

null

1,694.2

0.5

295

null

3

P 1 21/c 1

-P 2ybc

14

- C17 H12 S5 -

- C68 H48 S20 -

4

1

FR1309

Kaynak, F. Betül; Özbey, Süheyla; Öztürk, Turan; Ertaş, Erdal

5-Benzyl-5-phenyl[1,3]dithiolo[4,5-d][1,3]dithiole-2-thione

Acta Crystallographica Section C

2,001

57

3

319

320

10.1107/S0108270100019764

1.5418

CuKα

null

0.047

null

0.054

null

0.95

null

has coordinates

Kaynak, F. Betül; Özbey, Süheyla; Öztürk, Turan; Ertaş, Erdal 5-Benzyl-5-phenyl[1,3]dithiolo[4,5-d][1,3]dithiole-2-thione Acta Crystallographica Section C 57(3) (2001) 319-320

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011796.cif $ #-------------------------------------------------------------------...

2,011,797

6.2645

0.0007

5.444

0.0012

26.17

0.003

90

null

91.339

0.011

90

null

892.3

0.2

293

2

293

2

null

3

P 1 21/c 1

-P 2ybc

14

(±)-1-tetralone-3-carboxylic acid

(±)-4-oxo-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid

- C11 H10 O3 -

- C44 H40 O12 -

4

1

FR1312

Barcon, Alan; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.; Miller, Allan J.

(±)-1-Tetralone-3-carboxylic acid and (±)-1-tetralone-2-acetic acid: hydrogen bonding in two γ-keto acids

Acta Crystallographica Section C

2,001

57

3

325

328

10.1107/S0108270100020783

0.71073

MoKα

0.076

0.045

null

0.106

null

1.06

null

has coordinates,has Fobs

Barcon, Alan; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.; Miller, Allan J. (±)-1-Tetralone-3-carboxylic acid and (±)-1-tetralone-2-acetic acid: hydrogen bonding in two γ-keto acids Acta Crystallographica Section C 57(3) (2001) 325-328

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011797.cif $ #-------------------------------------------------------------------...

2,011,798

8.0008

0.001

10.579

0.002

12.6789

0.0013

90

null

105.616

0.008

90

null

1,033.5

0.3

293

2

293

2

null

3

P 1 21/n 1

-P 2yn

14

(±)-1-tetralone-2-acetic acid

(±)-1-oxo-1,2,3,4-tetrahydronaphthalene-2-acetic acid

- C12 H12 O3 -

- C48 H48 O12 -

4

1

FR1312

Barcon, Alan; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.; Miller, Allan J.

(±)-1-Tetralone-3-carboxylic acid and (±)-1-tetralone-2-acetic acid: hydrogen bonding in two γ-keto acids

Acta Crystallographica Section C

2,001

57

3

325

328

10.1107/S0108270100020783

0.71073

MoKα

0.069

0.043

null

0.109

null

1.04

null

has coordinates,has Fobs

Barcon, Alan; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.; Miller, Allan J. (±)-1-Tetralone-3-carboxylic acid and (±)-1-tetralone-2-acetic acid: hydrogen bonding in two γ-keto acids Acta Crystallographica Section C 57(3) (2001) 325-328

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/17/2011798.cif $ #-------------------------------------------------------------------...

2,011,799

16.807

0.002

9.3006

0.0016

13.7677

0.001

90

null

106.682

0.01

90

null

2,061.5

0.5

170

2

170

2

null

6

C 1 c 1

C -2yc

9

doxylamine tetrachlorocuprate(II)

{2-[1-dimethylammonioethoxy)-1-phenylethyl]pyridinium} tetrachlorocuprate(II)

- C17 H24 Cl4 Cu N2 O -

- C68 H96 Cl16 Cu4 N8 O4 -

4

1

FR1314

Braitenbach, Kristin; Parvez, Masood

Doxylaminium tetrachlorocuprate(II)

Acta Crystallographica Section C

2,001

57

3

262

263

10.1107/S010827010001917X

0.71069

MoKα

0.117

0.044

null

0.128

null

1.02

null

has coordinates,has Fobs

Braitenbach, Kristin; Parvez, Masood Doxylaminium tetrachlorocuprate(II) Acta Crystallographica Section C 57(3) (2001) 262-263

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/2/01/17/2011799.cif $ #-------------------------------------------------------------------...

2,011,800

10.755

0.0005

13.523

0.0003

26.764

0.001

90

null

87.356

0.002

90

null

3,888.4

0.2

190

null

190

null

9

P 1 21/n 1

-P 2yn

14

(4'-Chloro-2,2':6',2''-terpyridine-N,N',N'')(diethylphopshinothioato-S)platinu m(II) tetraphenylborate

- C43 H40 B Cl N3 O3 P Pt S -

- C172 H160 B4 Cl4 N12 O12 P4 Pt4 S4 -

4

1

GD1116

Ross, Steven A.; Lowe, Gordon; Watkin, David J.

(4'-Chloro-2,2':6',2''-terpyridine-N,N',N'')(diethylphosphinothioato-S)platinum(II) tetraphenylborate

Acta Crystallographica Section C

2,001

57

3

275

276

10.1107/S0108270100020023

0.71069

MoKα

null

0.03

null

0.037

null

1.026

null

has coordinates,has Fobs

Ross, Steven A.; Lowe, Gordon; Watkin, David J. (4'-Chloro-2,2':6',2''-terpyridine-N,N',N'')(diethylphosphinothioato-S)platinum(II) tetraphenylborate Acta Crystallographica Section C 57(3) (2001) 275-276

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/2/01/18/2011800.cif $ #-------------------------------------------------------------------...

2,011,801

5.886

0.002

8.402

0.003

8.923

0.003

116.8

0.03

104.04

0.03

92.53

0.03

376.1

0.3

293

2

295

2

null

4

P -1

-P 1

2

- C8 H8 N2 O2 -

- C16 H16 N4 O4 -

2

1

GD1117

Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz B.

1-Nitroindoline

Acta Crystallographica Section C

2,001

57

3

304

305

10.1107/S0108270100019144

0.71073

MoKα

0.0487

0.0368

null

0.1098

null

1.012

null

has coordinates

Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz B. 1-Nitroindoline Acta Crystallographica Section C 57(3) (2001) 304-305

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011801.cif $ #-------------------------------------------------------------------...

2,011,802

13.0265

0.0007

7.0672

0.0003

6.3376

0.0002

90

null

96.432

0.004

90

null

579.77

0.04

293

null

293

null

3

P 1 21 1

P 2yb

4

1,6-anhydro-2,3-O-(S)-benzylidene-β-D-mannopyranose

- C13 H14 O5 -

- C26 H28 O10 -

2

1

GD1120

Foces-Foces, C.

Three 1,6-anhydro-β-D-glycopyranose derivatives

Acta Crystallographica Section C

2,001

57

3

298

301

10.1107/S0108270100019065

1.54178

CuKα

0.029

null

0.032

null

0.032

null

1.001

null

1.001

null

has coordinates,has Fobs

Foces-Foces, C. Three 1,6-anhydro-β-D-glycopyranose derivatives Acta Crystallographica Section C 57(3) (2001) 298-301

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011802.cif $ #-------------------------------------------------------------------...

2,011,803

11.9752

0.0005

5.7487

0.0002

18.0759

0.0014

90

null

100.295

0.006

90

null

1,224.34

0.12

293

null

293

null

3

C 1 2 1

C 2y

5

1,6-anhydro-4-O-benzyl-β-D-mannopyranose

- C13 H16 O5 -

- C52 H64 O20 -

4

1

GD1120

Foces-Foces, C.

Three 1,6-anhydro-β-D-glycopyranose derivatives

Acta Crystallographica Section C

2,001

57

3

298

301

10.1107/S0108270100019065

1.54178

CuKα

0.032

null

0.04

null

0.04

null

1.08

null

1.081

null

has coordinates,has Fobs

Foces-Foces, C. Three 1,6-anhydro-β-D-glycopyranose derivatives Acta Crystallographica Section C 57(3) (2001) 298-301

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011803.cif $ #-------------------------------------------------------------------...

2,011,804

9.0956

0.0003

5.8461

0.0002

11.0603

0.0005

90

null

102.871

0.004

90

null

573.34

0.04

293

null

293

null

3

P 1 21 1

P 2yb

4

1,6-anhydro-3,4-O-(S)-benzylidene-β-D-galactopyranose

- C13 H14 O5 -

- C26 H28 O10 -

2

1

GD1120

Foces-Foces, C.

Three 1,6-anhydro-β-D-glycopyranose derivatives

Acta Crystallographica Section C

2,001

57

3

298

301

10.1107/S0108270100019065

1.54178

CuKα

0.034

null

0.043

null

0.043

null

1.046

null

1.046

null

has coordinates,has Fobs

Foces-Foces, C. Three 1,6-anhydro-β-D-glycopyranose derivatives Acta Crystallographica Section C 57(3) (2001) 298-301

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011804.cif $ #-------------------------------------------------------------------...

2,011,805

20.8676

0.0017

7.0151

0.0007

9.1087

0.0008

90

null

92.843

0.005

90

null

1,331.8

0.2

150

2

150

2

null

4

C 1 2/c 1

-C 2yc

15

2,5-Dihydroxy-1,4-benzoquinone–4,4'-bipyridine (1/1)

- C16 H12 N2 O4 -

- C64 H48 N8 O16 -

4

0.5

GD1125

Cowan, John A.; Howard, J. A. K.; Leech, M. A.

The 1:1 adduct of 2,5-dihydroxy-1,4-benzoquinone with 4,4'-bipyridine

Acta Crystallographica Section C

2,001

57

3

302

303

10.1107/S0108270100019077

0.71073

MoKα

0.049

0.041

null

0.113

null

1.062

null

has coordinates,has Fobs

Cowan, John A.; Howard, J. A. K.; Leech, M. A. The 1:1 adduct of 2,5-dihydroxy-1,4-benzoquinone with 4,4'-bipyridine Acta Crystallographica Section C 57(3) (2001) 302-303

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011805.cif $ #-------------------------------------------------------------------...

2,011,806

21.484

0.003

9.4624

0.0008

7.3293

0.0007

90

null

90

null

90

null

1,490

0.3

160

2

160

2

null

4

P b c n

-P 2n 2ab

60

Sodium hydrogenbis(phenoxyacetate)

- C16 H15 Na O6 -

- C64 H60 Na4 O24 -

4

0.5

GD1129

Evans, James; Kapitan, Anoop; Rosair, Georgina; Roberts, Kevin J; White, Graeme

Sodium hydrogen bis(phenoxyacetate)

Acta Crystallographica Section C

2,001

57

3

250

251

10.1107/S0108270100018175

0.71073

MoKα

0.058

0.0389

null

0.1088

null

0.959

null

has coordinates,has Fobs

Evans, James; Kapitan, Anoop; Rosair, Georgina; Roberts, Kevin J; White, Graeme Sodium hydrogen bis(phenoxyacetate) Acta Crystallographica Section C 57(3) (2001) 250-251

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/2/01/18/2011806.cif $ #-------------------------------------------------------------------...

2,011,807

11.8073

0.0013

10.0751

0.0012

21.453

0.003

90

null

116.024

0.008

90

null

2,293.3

0.5

150

2

150

2

null

4

P 1 21/c 1

-P 2ybc

14

- C26 H26 N4 Pd -

- C104 H104 N16 Pd4 -

4

1

GG1030

Ellis, Dianne D.; Spek, Anthony L.

[η^2^-(E)-But-2-enedinitrile](N,N'-diphenyl-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-diimine-N,N')palladium(0)

Acta Crystallographica Section C

2,001

57

3

235

236

10.1107/S0108270100016401

0.71073

MoKα

0.051

0.042

null

0.086

null

1.04

null

has coordinates,has disorder,has Fobs

Ellis, Dianne D.; Spek, Anthony L. [η^2^-(E)-But-2-enedinitrile](N,N'-diphenyl-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-diimine-N,N')palladium(0) Acta Crystallographica Section C 57(3) (2001) 235-236

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/2/01/18/2011807.cif $ #-------------------------------------------------------------------...

2,011,808

9.995

0.002

10.462

0.002

10.569

0.002

95.13

0.02

92.48

0.02

105.23

0.02

1,059.5

0.4

190

2

190

2

null

6

P -1

-P 1

2

- C26 H18 Cu F2 N2 O2 -

- C52 H36 Cu2 F4 N4 O4 -

2

1

GG1032

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R.

Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV)

Acta Crystallographica Section C

2,001

57

3

277

280

10.1107/S0108270100020059

0.71073

MoKα

0.054

0.04

null

0.115

null

1.095

null

has coordinates,has Fobs

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R. Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV) Acta Crystallographica Section C 57(3) (2001) 277-280

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011808.cif $ #-------------------------------------------------------------------...

2,011,809

10.752

0.001

7.893

0.001

27.391

0.003

90

null

90

null

90

null

2,324.6

0.4

150

2

150

2

null

6

P b c a

-P 2ac 2ab

61

- C28 H22 Cu F2 N2 O2 -

- C112 H88 Cu4 F8 N8 O8 -

4

0.5

GG1032

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R.

Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV)

Acta Crystallographica Section C

2,001

57

3

277

280

10.1107/S0108270100020059

0.71073

MoKα

0.069

0.043

null

0.121

null

1.013

null

has coordinates,has disorder,has Fobs

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R. Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV) Acta Crystallographica Section C 57(3) (2001) 277-280

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/2/01/18/2011809.cif $ #-------------------------------------------------------------------...

2,011,810

14.607

0.002

7.423

0.001

27.109

0.002

90

null

98.07

0.01

90

null

2,910.3

0.6

290

2

290

2

null

6

C 1 2/c 1

-C 2yc

15

- C30 H16 Cu F12 N2 O2 -

- C120 H64 Cu4 F48 N8 O8 -

4

0.5

GG1032

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R.

Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV)

Acta Crystallographica Section C

2,001

57

3

277

280

10.1107/S0108270100020059

0.71073

MoKα

0.058

0.039

null

0.096

null

1.039

null

has coordinates,has disorder,has Fobs

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R. Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV) Acta Crystallographica Section C 57(3) (2001) 277-280

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011810.cif $ #-------------------------------------------------------------------...

2,011,811

14.768

0.001

10.663

0.001

8.32

0.001

90

null

95.87

0.01

90

null

1,303.3

0.2

290

2

290

2

null

6

P 1 21/c 1

-P 2ybc

14

- C28 H18 Cu F6 N2 O4 -

- C56 H36 Cu2 F12 N4 O8 -

2

0.5

GG1032

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R.

Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV)

Acta Crystallographica Section C

2,001

57

3

277

280

10.1107/S0108270100020059

0.71073

MoKα

0.078

0.049

null

0.14

null

1.028

null

has coordinates,has disorder,has Fobs

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R. Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV) Acta Crystallographica Section C 57(3) (2001) 277-280

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011811.cif $ #-------------------------------------------------------------------...

2,011,812

27.392

0.003

10.048

0.002

9.654

0.001

90

null

94.84

0.01

90

null

2,647.6

0.7

190

2

190

2

null

6

P 1 21/c 1

-P 2ybc

14

- C28 H18 F6 N2 O5 V -

- C112 H72 F24 N8 O20 V4 -

4

1

GG1032

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R.

Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV)

Acta Crystallographica Section C

2,001

57

3

277

280

10.1107/S0108270100020059

0.71073

MoKα

0.061

0.042

null

0.108

null

1.034

null

has coordinates,has Fobs

Burgess, John; Fawcett, John; Palma, Vitor; Gilani, Syeda R. Fluoro derivatives of bis(salicylideneaminato-N,O)copper(II) and -oxovanadium(IV) Acta Crystallographica Section C 57(3) (2001) 277-280

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011812.cif $ #-------------------------------------------------------------------...

2,011,813

8.663

0.002

8.956

0.002

13.293

0.003

73.029

0.003

83.852

0.004

61.662

0.003

867.6

0.3

120

null

120

null

5

P -1

-P 1

2

aqua[bis(salicylidene)ethylenediaminato-O,N,N',O']oxovanadium(V) nitrate

- C16 H16 N3 O7 V -

- C32 H32 N6 O14 V2 -

2

1

GG1035

Hazell, Alan; Lund, Puk; Saugbjerg, Annemette

Two polymorphs of aqua[N,N'-ethylenebis(salicylideneaminato-N,O)]oxovanadium(V) nitrate

Acta Crystallographica Section C

2,001

57

3

257

259

10.1107/S0108270100019132

0.71073

MoKα

null

0.033

null

0.042

null

1.327

null

has coordinates

Hazell, Alan; Lund, Puk; Saugbjerg, Annemette Two polymorphs of aqua[N,N'-ethylenebis(salicylideneaminato-N,O)]oxovanadium(V) nitrate Acta Crystallographica Section C 57(3) (2001) 257-259

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011813.cif $ #-------------------------------------------------------------------...

2,011,814

16.413

0.002

8.1634

0.0008

25.628

0.003

90

null

96.619

0.002

90

null

3,410.9

0.7

120

null

120

null

5

C 1 2/c 1

-C 2yc

15

aqua[bis(salicylidene)ethylenediaminato-O,N,N',O']oxovanadium(V) nitrate

- C16 H16 N3 O7 V -

- C128 H128 N24 O56 V8 -

8

1

GG1035

Hazell, Alan; Lund, Puk; Saugbjerg, Annemette

Two polymorphs of aqua[N,N'-ethylenebis(salicylideneaminato-N,O)]oxovanadium(V) nitrate

Acta Crystallographica Section C

2,001

57

3

257

259

10.1107/S0108270100019132

0.71073

MoKα

null

0.05

null

0.047

null

1.059

null

has coordinates,has Fobs

Hazell, Alan; Lund, Puk; Saugbjerg, Annemette Two polymorphs of aqua[N,N'-ethylenebis(salicylideneaminato-N,O)]oxovanadium(V) nitrate Acta Crystallographica Section C 57(3) (2001) 257-259

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011814.cif $ #-------------------------------------------------------------------...

2,011,815

14.4773

0.0018

14.4773

0.0018

14.4773

0.0018

90

null

90

null

90

null

3,034.3

0.7

180

2

180

2

null

4

P a -3

-P 2ac 2ab 3

205

Tris(tert-butyl)phosphine selenide

- C12 H27 P Se -

- C96 H216 P8 Se8 -

8

0.333333

JZ1439

Steinberger, Hans-Uwe; Ziemer, Burkhard; Meisel, Manfred

Tris(tert-butyl)phosphine selenide, the missing link in tris(tert-butyl)phosphine chalcogenide structures ^t^Bu~3~P=X (X = O, S, Se, Te)

Acta Crystallographica Section C

2,001

57

3

323

324

10.1107/S010827010002000X

0.71073

MoKα

0.023

0.018

null

0.046

null

1.025

null

has coordinates,has disorder,has Fobs

Steinberger, Hans-Uwe; Ziemer, Burkhard; Meisel, Manfred Tris(tert-butyl)phosphine selenide, the missing link in tris(tert-butyl)phosphine chalcogenide structures ^t^Bu~3~P=X (X = O, S, Se, Te) Acta Crystallographica Section C 57(3) (2001) 323-324

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011815.cif $ #-------------------------------------------------------------------...

2,011,816

7.3003

0.0004

6.8114

0.0004

15.6135

0.0011

90

null

90

null

90

null

776.39

0.08

293

2

293

2

null

5

P n m a

-P 2ac 2n

62

- C8 H4 Cu N2 O4 -

- C32 H16 Cu4 N8 O16 -

4

0.5

LN1113

Näther, Christian; Jeß, Inke

Poly[copper(II)-μ-pyrazine-μ~3~-squarato]

Acta Crystallographica Section C

2,001

57

3

260

261

10.1107/S0108270100018722

0.71073

MoKα

0.0397

0.0356

null

0.099

null

1.064

null

has coordinates,has Fobs

Näther, Christian; Jeß, Inke Poly[copper(II)-μ-pyrazine-μ~3~-squarato] Acta Crystallographica Section C 57(3) (2001) 260-261

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/2/01/18/2011816.cif $ #-------------------------------------------------------------------...

2,011,817

11.794

0.002

20.179

0.004

17.843

0.004

90

null

107.78

0.03

90

null

4,043.6

1.5

150

2

150

2

null

5

P 1 21/n 1

-P 2yn

14

octakis(4-isopropylpyridine-N)-di-μ~4~-oxo-hexa-μ~3~-oxo-octa-μ~2~-oxo- decaoxooctamolybdenum(V)dimolybdenum(VI)

- C64 H88 Mo10 N8 O26 -

- C128 H176 Mo20 N16 O52 -

2

0.5

NA1493

Modec, Barbara; Brenčič, Jurij V.; Giester, Gerald

A decanuclear oxomolybdenum(V,VI) cluster with 4-isopropylpyridine

Acta Crystallographica Section C

2,001

57

3

246

247

10.1107/S0108270100017303

0.71073

MoKα

0.058

0.041

null

0.092

0.086

null

1.069

1.121

null

has coordinates,has Fobs

Modec, Barbara; Brenčič, Jurij V.; Giester, Gerald A decanuclear oxomolybdenum(V,VI) cluster with 4-isopropylpyridine Acta Crystallographica Section C 57(3) (2001) 246-247

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011817.cif $ #-------------------------------------------------------------------...

2,011,818

10.56

0.1

32.98

0.15

11.64

0.08

90

null

92.8

0.7

90

null

4,049

5

298

null

298

null

6

P 1 21/c 1

-P 2ybc

14

[Bis(tetrahydrofuran-κO)(meso-5,10,15,20-tetraisopropylporphyrinato-κ^4^N) iron(III)] perchlorate

- C40 H52 Cl Fe N4 O6 -

- C160 H208 Cl4 Fe4 N16 O24 -

4

1

OA1111

Ohgo, Yoshiki; Saitoh, Takashi; Nakamura, Mikio

Bis(tetrahydrofuran-κO)(meso-5,10,15,20-tetraisopropylporphyrinato-κ^4^N)iron(III) perchlorate

Acta Crystallographica Section C

2,001

57

3

233

234

10.1107/S0108270100015833

0.71069

MoKα

0.168

0.063

null

0.215

null

0.911

null

has coordinates,has disorder

Ohgo, Yoshiki; Saitoh, Takashi; Nakamura, Mikio Bis(tetrahydrofuran-κO)(meso-5,10,15,20-tetraisopropylporphyrinato-κ^4^N)iron(III) perchlorate Acta Crystallographica Section C 57(3) (2001) 233-234

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/2/01/18/2011818.cif $ #-------------------------------------------------------------------...

2,011,819

16.0884

0.0004

23.1083

0.0005

25.8233

0.0006

90

null

104.09

0.001

90

null

9,311.6

0.4

150

1

150

1

null

7

P 1 21/c 1

-P 2ybc

14

[{K(18-crown-6-ether)(H~2~O)}~2~{K(18-crown-6-ether)(H~2~O)~2~}] [Rh~2~(O~2~CC~6~H~5~)~4~Fe(CN)~6~]8H~2~O (18-crown-6-ether = 1,4,7,10,13,16-hexaoxacyclooctadecane)

- C70 H116 Fe K3 N6 O38 Rh2 -

- C280 H464 Fe4 K12 N24 O152 Rh8 -

4

1

OA1112

Kim, Youngmee; Kim, Sung-Jin; Nam, Wonwoo

A ferric-cyanide-bridged one-dimensional dirhodium complex with (18-crown-6)potassium cations

Acta Crystallographica Section C

2,001

57

3

266

268

10.1107/S0108270100019776

0.71073

MoKα

0.0959

0.0525

null

0.1157

null

1.022

null

has coordinates,has Fobs

Kim, Youngmee; Kim, Sung-Jin; Nam, Wonwoo A ferric-cyanide-bridged one-dimensional dirhodium complex with (18-crown-6)potassium cations Acta Crystallographica Section C 57(3) (2001) 266-268

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/2/01/18/2011819.cif $ #-------------------------------------------------------------------...

2,011,820

6.1387

0.0003

6.1387

0.0003

11.4071

0.0009

90

null

90

null

120

null

372.27

0.04

293

null

293

2

null

3

P 63 c m

P 6c -2

185

Yttrium manganese oxide

- Mn O3 Y -

- Mn6 O18 Y6 -

6

0.5

SK1421

Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T.M.

Hexagonal YMnO~3~

Acta Crystallographica Section C

2,001

57

3

230

232

10.1107/S0108270100015663

0.71073

MoKα

0.0506

0.0372

null

0.1065

null

1.117

null

has coordinates

Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T.M. Hexagonal YMnO~3~ Acta Crystallographica Section C 57(3) (2001) 230-232

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/2/01/18/2011820.cif $ #-------------------------------------------------------------------...

2,011,821

6.1277

0.0005

6.1277

0.0005

11.411

0.001

90

null

90

null

120

null

371.06

0.05

180

null

180

2

null

3

P 63 c m

P 6c -2

185

Ytrrium Manganese oxide

- Mn O3 Y -

- Mn6 O18 Y6 -

6

0.5

SK1421

Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T.M.

Hexagonal YMnO~3~

Acta Crystallographica Section C

2,001

57

3

230

232

10.1107/S0108270100015663

0.71073

MoKα

0.0484

0.0372

null

0.1085

null

1.094

null

has coordinates,has Fobs

Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T.M. Hexagonal YMnO~3~ Acta Crystallographica Section C 57(3) (2001) 230-232

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/2/01/18/2011821.cif $ #-------------------------------------------------------------------...

2,011,822

8.026

0.002

12.359

0.003

14.056

0.003

90

null

96.63

0.02

90

null

1,384.9

0.6

293

null

293

null

4

P 1 21 1

P 2yb

4

- C29 H29 N O9 -

- C58 H58 N2 O18 -

2

1

SK1434

Renaudet, Olivier; Dumy, Pascal; Philouze, Christian

Methyl 2,3,6-tri-O-benzoyl-4-deoxy-4-methoxyamino-α-D-glucopyranoside

Acta Crystallographica Section C

2,001

57

3

309

310

10.1107/S0108270100019387

0.7107

MoKα

0.068

null

0.04

null

0.04

null

1.896

null

1.896

null

has coordinates,has Fobs

Renaudet, Olivier; Dumy, Pascal; Philouze, Christian Methyl 2,3,6-tri-O-benzoyl-4-deoxy-4-methoxyamino-α-D-glucopyranoside Acta Crystallographica Section C 57(3) (2001) 309-310

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011822.cif $ #-------------------------------------------------------------------...

2,011,823

12.1752

0.0002

22.2029

0.0001

19.8479

0.0004

90

null

117.168

0.001

90

null

4,773.42

0.13

293

2

293

2

null

5

P 1 21/c 1

-P 2ybc

14

Bis[2,2'-ethylenedioxydibenzaldehyde bis(thiocarbohydrazide)] tripyridine

- C49 H47 N11 O4 S2 -

- C196 H188 N44 O16 S8 -

4

1

SK1435

Chantrapromma, Suchada; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Karalai, Chatchanok; Zhang, Hao; Xie, Fu-Xin; Tian, Yu-Peng; Ma, Wen; Zhang, Yin-Han; Ni, Shi-Sheng

Bis[2,2'-ethylenedioxydibenzaldehyde bis(thiocarbohydrazide)] tris(pyridine) solvate

Acta Crystallographica Section C

2,001

57

3

289

290

10.1107/S0108270100017972

0.71073

MoKα

0.135

0.068

null

0.166

null

1.051

null

has coordinates,has disorder,has Fobs

Chantrapromma, Suchada; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Karalai, Chatchanok; Zhang, Hao; Xie, Fu-Xin; Tian, Yu-Peng; Ma, Wen; Zhang, Yin-Han; Ni, Shi-Sheng Bis[2,2'-ethylenedioxydibenzaldehyde bis(thiocarbohydrazide)] tris(pyridine) solvate Acta Crystallographica Section C 57(3) (2001) 289-290

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011823.cif $ #-------------------------------------------------------------------...

2,011,824

13.8921

0.0009

15.339

0.0006

14.0209

0.0008

90

null

95.666

0.002

90

null

2,973.1

0.3

150

2

150

2

null

4

P 1 21/n 1

-P 2yn

14

Racemic 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane‒ 1,3,5-benzenetricarboxylic acid‒methanol‒water (1/1/0.78/1.12)

- C25.78 H47.36 N4 O7.9 -

- C25.784 H44.8 N4 O7.9 -

- C103.136 H179.2 N16 O31.6 -

4

1

SK1438

Burchell, Colin J.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher

Hydrogen-bonded sheets in the 1:1 salt of tet-b and trimesic acid

Acta Crystallographica Section C

2,001

57

3

311

314

10.1107/S0108270100019399

0.71073

MoKα

0.138

0.077

null

0.212

null

0.986

null

has coordinates,has disorder,has Fobs

Burchell, Colin J.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Hydrogen-bonded sheets in the 1:1 salt of tet-b and trimesic acid Acta Crystallographica Section C 57(3) (2001) 311-314

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/2/01/18/2011824.cif $ #-------------------------------------------------------------------...

2,011,825

8.8444

0.0003

9.7581

0.0002

11.922

0.0003

112.009

0.001

94.99

0.001

99.585

0.001

927.98

0.04

298

2

298

2

null

5

P -1

-P 1

2

Bis(dicyclohexylammonium 3-thienylacetate)

- C36 H58 N2 O4 S2 -

1

0.5

SK1439

Ng, Seik Weng; Chantrapromma, Suchada; Razak, Ibrahim Abdul; Fun, Hoong-Kun

Bis(dicyclohexylammonium 3-thienylacetate)

Acta Crystallographica Section C

2,001

57

3

291

292

10.1107/S0108270100019326

0.71073

MoKα

0.0831

0.0602

null

0.1622

null

0.926

null

has coordinates,has disorder,has Fobs

Ng, Seik Weng; Chantrapromma, Suchada; Razak, Ibrahim Abdul; Fun, Hoong-Kun Bis(dicyclohexylammonium 3-thienylacetate) Acta Crystallographica Section C 57(3) (2001) 291-292

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011825.cif $ #-------------------------------------------------------------------...

2,011,826

7.764

0.003

7.881

0.0015

13.047

0.0015

79.507

0.006

78.79

0.011

63.308

0.011

695.5

0.3

293

2

293

2

null

5

P -1

-P 1

2

Racemic cis-dichlorobis(pentane-2,4-dionato)titanium(IV)

- C10 H14 Cl2 O4 Ti -

- C20 H28 Cl4 O8 Ti2 -

2

1

SK1440

Ferguson, George; Glidewell, Christopher; .

Enantiomeric disorder in racemic cis-dichlorobis(pentane-2,4-dionato)titanium(IV)

Acta Crystallographica Section C

2,001

57

3

264

265

10.1107/S0108270100019181

0.71073

MoKα

0.1571

0.0529

null

0.1709

null

0.942

null

has coordinates,has disorder

Ferguson, George; Glidewell, Christopher; . Enantiomeric disorder in racemic cis-dichlorobis(pentane-2,4-dionato)titanium(IV) Acta Crystallographica Section C 57(3) (2001) 264-265

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/2/01/18/2011826.cif $ #-------------------------------------------------------------------...

2,011,827

7.6113

0.0005

11.6304

0.0007

8.2286

0.0005

90

null

94.05

0.002

90

null

726.6

0.08

150

2

150

2

null

4

I 1 a 1

I -2ya

9

2-Methyl-4-nitroaniline

- C7 H8 N2 O2 -

- C28 H32 N8 O8 -

4

1

SK1442

Ferguson, George; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.

Hydrogen bonding in C-methylated nitroanilines: the three-dimensional framework structure of 2-methyl-4-nitroaniline

Acta Crystallographica Section C

2,001

57

3

315

316

10.1107/S0108270100019405

0.71073

MoKα

0.056

0.043

null

0.113

null

0.995

null

has coordinates,has Fobs

Ferguson, George; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L. Hydrogen bonding in C-methylated nitroanilines: the three-dimensional framework structure of 2-methyl-4-nitroaniline Acta Crystallographica Section C 57(3) (2001) 315-316

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011827.cif $ #-------------------------------------------------------------------...

2,011,828

11.224

0.001

13.65

0.001

14.11

0.001

75.27

0.002

73.07

0.002

76.27

0.002

1,968.7

0.3

293

null

3

P -1

-P 1

2

- C23 H22 N6 -

- C92 H88 N24 -

4

2

SX1110

Moreno-Fuquen, Rodolfo; Abonia, Rodrigo; Valderrama-Naranjo, Jaime; Albornoz, Andrea; Mariezcurrena, Raul

5,12-Dimethyl-3,10-diphenyl-1,3,4,8,10,11-hexaazatetracyclo[6.6.1.0^2,6^.0^9,13^]pentadeca-2(6),4,9(13),11-tetraene, a new Tröger's base analogue

Acta Crystallographica Section C

2,001

57

3

281

283

10.1107/S0108270100012531

0.71069

MoKα

0.098

0.043

null

0.141

null

1.016

null

has coordinates,has Fobs

Moreno-Fuquen, Rodolfo; Abonia, Rodrigo; Valderrama-Naranjo, Jaime; Albornoz, Andrea; Mariezcurrena, Raul 5,12-Dimethyl-3,10-diphenyl-1,3,4,8,10,11-hexaazatetracyclo[6.6.1.0^2,6^.0^9,13^]pentadeca-2(6),4,9(13),11-tetraene, a new Tröger's base analogue Acta Crystallographica Section C 57(3) (2001) 281-283

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011828.cif $ #-------------------------------------------------------------------...

2,011,829

9.9411

0.0016

18.0364

0.0014

7.3758

0.0018

90

null

90

null

90

null

1,322.5

0.4

273

2

273

2

null

4

P 21 21 21

P 2ac 2ab

19

maílione

- C14 H19 Br O2 -

- C56 H76 Br4 O8 -

4

1

SX1116

Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Davyt, Danilo; Fernández, Rafael; Manta, Eduardo

Two natural products from the algae Laurencia scoparia

Acta Crystallographica Section C

2,001

57

3

286

288

10.1107/S0108270100017935

0.71069

MoKα

0.115

0.044

null

0.128

null

0.936

null

has coordinates,has Fobs

Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Davyt, Danilo; Fernández, Rafael; Manta, Eduardo Two natural products from the algae Laurencia scoparia Acta Crystallographica Section C 57(3) (2001) 286-288

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011829.cif $ #-------------------------------------------------------------------...

2,011,830

11.872

0.005

11.897

0.004

21.575

0.004

90

null

90

null

90

null

3,047.3

1.7

273

2

273

2

null

4

P 21 21 21

P 2ac 2ab

19

isorigidol

- C15 H23 Br O2 -

- C120 H184 Br8 O16 -

8

2

SX1116

Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Davyt, Danilo; Fernández, Rafael; Manta, Eduardo

Two natural products from the algae Laurencia scoparia

Acta Crystallographica Section C

2,001

57

3

286

288

10.1107/S0108270100017935

0.71069

MoKα

0.117

0.034

null

0.094

null

0.941

null

has coordinates,has Fobs

Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Davyt, Danilo; Fernández, Rafael; Manta, Eduardo Two natural products from the algae Laurencia scoparia Acta Crystallographica Section C 57(3) (2001) 286-288

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011830.cif $ #-------------------------------------------------------------------...

2,011,831

10.4243

0.0014

20.3334

0.0018

8.3832

0.0011

90

null

85.639

0.013

90

null

1,771.8

0.4

295

null

5

P 1 21/c 1

-P 2ybc

14

- C38 H38 N4 O8 Zn3 -

- C76 H76 N8 O16 Zn6 -

2

0.5

TA1298

Ülkü, Dinçer; Tatar, Leyla; Atakol, Orhan; Aksu, Mecit

Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]zinc(II)}zinc(II)

Acta Crystallographica Section C

2,001

57

3

273

274

10.1107/S0108270100019983

0.71073

MoKα

null

0.045

null

0.056

null

1.01

null

has coordinates

Ülkü, Dinçer; Tatar, Leyla; Atakol, Orhan; Aksu, Mecit Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]zinc(II)}zinc(II) Acta Crystallographica Section C 57(3) (2001) 273-274

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011831.cif $ #-------------------------------------------------------------------...

2,011,832

15.529

0.003

14.77

0.003

10.477

0.002

90

null

92.02

0.03

90

null

2,401.5

0.8

294

2

294

2

null

6

P 1 21/c 1

-P 2ybc

14

μ-hexavanadato(V)-bis[bis(2,2'-bipyridine)nickel(II)]

- C40 H32 N8 Ni2 O17 V6 -

- C80 H64 N16 Ni4 O34 V12 -

2

0.5

TA1302

Lin, Bi-Zhou; Liu, Shi-Xinog

Polymeric bis[bis(2,2'-bipyridine)nickel(II)] hexavanadate(V)

Acta Crystallographica, Section C: Crystal Structure Communications

2,001

57

3

243

245

10.1107/S0108270100017339

0.71069

MoKα

0.072

0.043

null

0.13

null

0.115

null

1.05

null

1.085

null

has coordinates,has Fobs

Lin, Bi-Zhou; Liu, Shi-Xinog Polymeric bis[bis(2,2'-bipyridine)nickel(II)] hexavanadate(V) Acta Crystallographica, Section C: Crystal Structure Communications 57(3) (2001) 243-245

209,472

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2018-08-08 05:17:29 +0300 (Wed, 08 Aug 2018) $ #$Revision: 209472 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/18/2011832.cif $ #-------------------------------------------------------------------...

2,011,833

6.6009

0.0011

10.9678

0.0017

20.278

0.005

90

null

92.704

0.016

90

null

1,466.4

0.5

293

2

293

2

null

5

P 1 21/c 1

-P 2ybc

14

[5,10,15,20-Tetrakis(2-thienyl)porphyrinato]zinc(II)

- C36 H20 N4 S4 Zn -

- C36 H8 N4 S4.002 Zn -

- C72 H16 N8 S8.004 Zn2 -

2

0.5

VJ1107

Purushothaman, Bhavana; Varghese, Babu; Bhyrappa, Puttaiah

[5,10,15,20-Tetrakis(2-thienyl)porphyrinato]zinc(II)

Acta Crystallographica Section C

2,001

57

3

252

253

10.1107/S0108270100018552

0.71073

MoKα

0.055

0.04

null

0.121

null

1.151

null

has coordinates,has Fobs

Purushothaman, Bhavana; Varghese, Babu; Bhyrappa, Puttaiah [5,10,15,20-Tetrakis(2-thienyl)porphyrinato]zinc(II) Acta Crystallographica Section C 57(3) (2001) 252-253

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/2/01/18/2011833.cif $ #-------------------------------------------------------------------...

2,011,834

11.3887

0.001

22.0576

0.0019

11.7301

0.001

90

null

113.33

0.001

90

null

2,705.8

0.4

293

2

293

2

null

5

P 1 21/c 1

-P 2ybc

14

N-(tolyl-p-sulfonyl)-3-aza-1,5-bis(tolyl-p-sulfonyloxy)pentane

- C25 H29 N O8 S3 -

- C100 H116 N4 O32 S12 -

4

1

VJ1127

Yoon, Il; Park, Ki-Min; Lee, Shim Sung

Tritosylate of diethanolamine

Acta Crystallographica Section C

2,001

57

3

321

322

10.1107/S0108270100019788

0.71073

MoKα

0.1019

0.0465

null

0.1358

null

1.003

null

has coordinates,has Fobs

Yoon, Il; Park, Ki-Min; Lee, Shim Sung Tritosylate of diethanolamine Acta Crystallographica Section C 57(3) (2001) 321-322

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011834.cif $ #-------------------------------------------------------------------...

2,011,835

13.249

0.004

10.086

0.009

16.695

0.005

90

null

101.99

0.02

90

null

2,182

2

293

2

293

2

null

6

P 1 21/n 1

-P 2yn

14

- C21 H21 Cl3 N2 Ni O2 -

- C84 H84 Cl12 N8 Ni4 O8 -

4

1

AV1056

de Castro, B.; Freire, C.; Duarte, M. Teresa; Minas da Piedade, M.F.; Santos, I.C.

trans-[N,N'-Bis(salicylidene)cyclohexane-1,2-diaminato]nickel(II)–chloroform (1/1)

Acta Crystallographica Section C

2,001

57

4

370

372

10.1107/S0108270100020849

0.71069

MoKα

0.066

0.0501

null

0.156

null

1.06

null

has coordinates,has Fobs

de Castro, B.; Freire, C.; Duarte, M. Teresa; Minas da Piedade, M.F.; Santos, I.C. trans-[N,N'-Bis(salicylidene)cyclohexane-1,2-diaminato]nickel(II)–chloroform (1/1) Acta Crystallographica Section C 57(4) (2001) 370-372

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011835.cif $ #-------------------------------------------------------------------...

2,011,836

7.573

0.001

17.75

0.001

8.277

0.001

90

null

93.53

0.01

90

null

1,110.5

0.2

298

null

4

P 1 21/c 1

-P 2ybc

14

- C14 H11 N O2 -

- C56 H44 N4 O8 -

4

1

AV1060

Hökelek, Tuncer; Patır, Süleyman; Ergün, Yavuz; Okay, Gürol

4-Methylcarbazole-3-carboxylic acid

Acta Crystallographica Section C

2,001

57

4

414

416

10.1107/S0108270100020199

1.5418

CuKα

null

0.061

null

0.071

null

0.87

null

has coordinates

Hökelek, Tuncer; Patır, Süleyman; Ergün, Yavuz; Okay, Gürol 4-Methylcarbazole-3-carboxylic acid Acta Crystallographica Section C 57(4) (2001) 414-416

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011836.cif $ #-------------------------------------------------------------------...

2,011,837

13.4239

0.0011

7.2198

0.0005

25.441

0.003

90

null

90

null

90

null

2,465.7

0.4

298

2

298

2

null

3

P b c a

-P 2ac 2ab

61

3-Phenylfuro[3,2-c]chromen-4-one

- C17 H10 O3 -

- C136 H80 O24 -

8

1

AV1062

Bruno, Giuseppe; Nicoló, Francesco; Rotondo, Archimede; Foti, Francesco; Risitano, Francesco; Grassi, Giovanni; Bilardo, Cristina

3-Phenyl-4H-furo[3,2-c]chromen-4-one

Acta Crystallographica Section C

2,001

57

4

493

494

10.1107/S0108270101001433

0.71073

MoKα

0.111

0.052

null

0.123

null

0.98

null

has coordinates,has Fobs

Bruno, Giuseppe; Nicoló, Francesco; Rotondo, Archimede; Foti, Francesco; Risitano, Francesco; Grassi, Giovanni; Bilardo, Cristina 3-Phenyl-4H-furo[3,2-c]chromen-4-one Acta Crystallographica Section C 57(4) (2001) 493-494

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011837.cif $ #-------------------------------------------------------------------...

2,011,838

9.3261

0.0003

32.34003

0.00014

7.5005

0.0003

90

null

90.595

0.002

90

null

2,262.08

0.12

290

1

290

1

null

5

P 1 21/n 1

-P 2yn

14

n-heptylammonium dihydrogenarsenate

- C7 H20 As N O4 -

- C56 H160 As8 N8 O32 -

8

2

AV1066

Fábry, Jan; Krupková, Radmila; Císařová, Ivana

Ferroelastic n-heptylammonium dihydrogenarsenate

Acta Crystallographica Section C

2,001

57

4

403

405

10.1107/S0108270100020850

0.71073

MoKα

0.0916

0.0435

null

0.0532

null

0.0532

null

1.46

1.92

1.46

null

has coordinates,has Fobs

Fábry, Jan; Krupková, Radmila; Císařová, Ivana Ferroelastic n-heptylammonium dihydrogenarsenate Acta Crystallographica Section C 57(4) (2001) 403-405

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011838.cif $ #-------------------------------------------------------------------...

2,011,839

11.1331

0.0005

11.8704

0.0006

18.8044

0.0007

92.239

0.003

101.526

0.003

91.353

0.003

2,431.86

0.19

100

2

100

2

null

7

P -1

-P 1

2

- C88 H108 Cl8 Gd2 N12 O10 U -

- C90 H98 Cl8 Gd2 N10 O10 U -

1

0.5

AV1069

Pons y Moll, Olivier; Le Borgne, Thierry; Thuéry, Pierre; Ephritikhine, Michel

An ion pair uniting a gadolinium(III)‒Schiff base complex and uranyl tetrachloride

Acta Crystallographica Section C

2,001

57

4

392

393

10.1107/S0108270101001445

0.71073

MoKα

0.055

0.038

null

0.099

null

1.019

null

has coordinates,has Fobs

Pons y Moll, Olivier; Le Borgne, Thierry; Thuéry, Pierre; Ephritikhine, Michel An ion pair uniting a gadolinium(III)‒Schiff base complex and uranyl tetrachloride Acta Crystallographica Section C 57(4) (2001) 392-393

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/2/01/18/2011839.cif $ #-------------------------------------------------------------------...

2,011,840

6.2806

0.0016

13.5616

0.0013

9.6165

0.001

90

null

107.488

0.011

90

null

781.2

0.2

293

2

293

2

null

4

P 1 21/n 1

-P 2yn

14

tricine

N-[tris(hydroxymethyl)methyl]glycine or N-(2-hydroxy-1,1-bis[hydroxymethyl]ethyl)glycine

- C6 H13 N O5 -

- C24 H52 N4 O20 -

4

1

BJ1011

Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L.

N-[Tris(hydroxymethyl)methyl]glycine (tricine)

Acta Crystallographica Section C

2,001

57

4

421

422

10.1107/S0108270100020266

0.71073

MoKα

0.039

0.03

null

0.089

null

1.063

null

has coordinates,has Fobs

Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L. N-[Tris(hydroxymethyl)methyl]glycine (tricine) Acta Crystallographica Section C 57(4) (2001) 421-422

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011840.cif $ #-------------------------------------------------------------------...

2,011,841

7.522

0.002

13.856

0.003

15.544

0.003

90

null

94.75

0.03

90

null

1,614.5

0.6

295

2

295

2

null

5

P 1 c 1

P -2yc

7

Aminoguanidinium(1+)(2+) heksachloroantimonate(III)

- C2 H15 Cl6 N8 Sb -

- C8 H60 Cl24 N32 Sb4 -

4

2

BJ1014

Bujak, Maciej; Osadczuk, Przemysław; Zaleski, Jacek

Aminoguanidinium(2+) aminoguanidinium(1+) hexachloroantimonate(III) at 295 and 92K

Acta Crystallographica Section C

2,001

57

4

388

391

10.1107/S0108270101000774

0.71073

MoKα

0.0327

0.0244

null

0.0645

null

1.097

null

has coordinates

Bujak, Maciej; Osadczuk, Przemysław; Zaleski, Jacek Aminoguanidinium(2+) aminoguanidinium(1+) hexachloroantimonate(III) at 295 and 92K Acta Crystallographica Section C 57(4) (2001) 388-391

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/2/01/18/2011841.cif $ #-------------------------------------------------------------------...

2,011,842

7.426

0.002

13.836

0.003

15.403

0.003

90

null

95.27

0.03

90

null

1,575.9

0.6

92

0.5

295

2

null

5

P 1 c 1

P -2yc

7

Aminoguanidinium(1+)(2+) heksachloroantimonate(III)

- C2 H15 Cl6 N8 Sb -

- C8 H60 Cl24 N32 Sb4 -

4

2

BJ1014

Bujak, Maciej; Osadczuk, Przemysław; Zaleski, Jacek

Aminoguanidinium(2+) aminoguanidinium(1+) hexachloroantimonate(III) at 295 and 92K

Acta Crystallographica Section C

2,001

57

4

388

391

10.1107/S0108270101000774

0.71073

MoKα

0.0212

0.0192

null

0.0477

null

1.093

null

has coordinates

Bujak, Maciej; Osadczuk, Przemysław; Zaleski, Jacek Aminoguanidinium(2+) aminoguanidinium(1+) hexachloroantimonate(III) at 295 and 92K Acta Crystallographica Section C 57(4) (2001) 388-391

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/2/01/18/2011842.cif $ #-------------------------------------------------------------------...

2,011,843

12.596

0.008

7.157

0.002

16.498

0.003

90

null

95.53

0.03

90

null

1,480.4

1.1

293

2

293

2

null

4

C 1 2/c 1

-C 2yc

15

2,2'-(2,4,8,10-tetrathiaspiro[5.5]undecane-3,9-diylidene)bis(propanedinitrile)

- C13 H8 N4 S4 -

- C52 H32 N16 S16 -

4

0.5

BJ1015

Zhou, Zheng-Rong; Xu, Wei; Xia, Yi; Wang, Quan-Rui; Ding, Zong-Biao; Chen, Min-Qin; Hua, Zhong-Yi; Tao, Feng-Gang

3,9-Bis(dicyanomethylene)-2,4,8,10-tetrathiaspiro[5.5]undecane

Acta Crystallographica Section C

2,001

57

4

471

472

10.1107/S0108270101000543

0.71073

MoKα

0.103

0.057

null

0.177

null

1.036

null

has coordinates,has Fobs

Zhou, Zheng-Rong; Xu, Wei; Xia, Yi; Wang, Quan-Rui; Ding, Zong-Biao; Chen, Min-Qin; Hua, Zhong-Yi; Tao, Feng-Gang 3,9-Bis(dicyanomethylene)-2,4,8,10-tetrathiaspiro[5.5]undecane Acta Crystallographica Section C 57(4) (2001) 471-472

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011843.cif $ #-------------------------------------------------------------------...

2,011,844

25.4244

0.0005

5.056

0.0001

18.9045

0.0004

90

null

126.327

0.001

90

null

1,957.8

0.07

173

2

173

2

null

6

C 1 2/c 1

-C 2yc

15

Poly[[{(1,2-η)-benzene}silver(I)]-μ-trifluoromethanesulfonate-O;O';O'':O'']

- C7 H6 Ag F3 O3 S -

- C56 H48 Ag8 F24 O24 S8 -

8

1

BJ1018

Wadepohl, Hubert; Pritzkow, Hans

Poly[[[(1,2-η)-benzene]silver(I)]-μ-trifluoromethanesulfonate-O;O';O'':O'']

Acta Crystallographica Section C

2,001

57

4

383

384

10.1107/S0108270101000610

0.71073

MoKα

0.025

0.023

null

0.06

null

1.085

null

has coordinates,has Fobs

Wadepohl, Hubert; Pritzkow, Hans Poly[[[(1,2-η)-benzene]silver(I)]-μ-trifluoromethanesulfonate-O;O';O'':O''] Acta Crystallographica Section C 57(4) (2001) 383-384

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/2/01/18/2011844.cif $ #-------------------------------------------------------------------...

2,011,845

9.8818

0.0017

27.375

0.006

9.811

0.0012

90

null

90

null

90

null

2,654

0.8

296

null

296

null

3

P b c a

-P 2ac 2ab

61

9-(1-Acetoxyethylidene)fluorene

- C17 H14 O2 -

- C136 H112 O16 -

8

1

BJ1021

Robinson, Paul D.; Lutfi, Hisham G.; Hou, Yuqing; Meyers, Cal Y.

9-(1-Acetoxyethylidene)fluorene (`diacetylfluorene'), a by-product from the acetylation of 9-fluorenyllithium

Acta Crystallographica Section C

2,001

57

4

428

430

10.1107/S0108270100020539

0.71069

MoKα

0.143

0.041

null

0.115

null

0.96

null

has coordinates,has Fobs

Robinson, Paul D.; Lutfi, Hisham G.; Hou, Yuqing; Meyers, Cal Y. 9-(1-Acetoxyethylidene)fluorene (`diacetylfluorene'), a by-product from the acetylation of 9-fluorenyllithium Acta Crystallographica Section C 57(4) (2001) 428-430

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011845.cif $ #-------------------------------------------------------------------...

2,011,846

9.319

0.0005

7.7083

0.0007

16.816

0.0014

90

null

102.422

0.004

90

null

1,179.68

0.16

120

null

120

null

5

P 1 21 1

P 2yb

4

pteropodine

(1'S,3R,4'aS,5'aS,10'aS)-1,2,5',5'a,7',8',10',10'a-octahydro-1'- methyl-2-oxo-spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4- f]indolizine]-4'-carboxylic acid methyl ester, chloroform solvate

- C22 H25 Cl3 N2 O4 -

- C44 H50 Cl6 N4 O8 -

2

1

BJ1025

Muhammad, Ilias; Khan, Ikhlas A.; Fischer, Nikolaus H.; Fronczek, Frank R.

Two stereoisomeric pentacyclic oxindole alkaloids from Uncaria tomentosa: uncarine C and uncarine E

Acta Crystallographica Section C

2,001

57

4

480

482

10.1107/S0108270101000932

0.71073

MoKα

0.095

0.059

null

0.16

null

0.98

null

has coordinates,has disorder

Muhammad, Ilias; Khan, Ikhlas A.; Fischer, Nikolaus H.; Fronczek, Frank R. Two stereoisomeric pentacyclic oxindole alkaloids from Uncaria tomentosa: uncarine C and uncarine E Acta Crystallographica Section C 57(4) (2001) 480-482

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011846.cif $ #-------------------------------------------------------------------...

2,011,847

10.9943

0.0008

21.062

0.003

12.3039

0.0015

90

null

96.86

0.006

90

null

2,828.7

0.6

120

null

120

null

4

P 1 21 1

P 2yb

4

isopteropodine

(1'S,3S,4'aS,5'aS,10'aS)-1,2,5',5'a,7',8', 10',10'a-octahydro -1'-methyl-2-oxo-spiro[3H-indole-3,6'(4'aH)-[1H]pyrano[3,4-f] indolizine]-4'-carboxylic acid methyl ester

- C21 H24 N2 O4 -

- C126 H144 N12 O24 -

6

3

BJ1025

Muhammad, Ilias; Khan, Ikhlas A.; Fischer, Nikolaus H.; Fronczek, Frank R.

Two stereoisomeric pentacyclic oxindole alkaloids from Uncaria tomentosa: uncarine C and uncarine E

Acta Crystallographica Section C

2,001

57

4

480

482

10.1107/S0108270101000932

0.71073

MoKα

0.123

0.052

null

0.108

null

0.894

null

has coordinates

Muhammad, Ilias; Khan, Ikhlas A.; Fischer, Nikolaus H.; Fronczek, Frank R. Two stereoisomeric pentacyclic oxindole alkaloids from Uncaria tomentosa: uncarine C and uncarine E Acta Crystallographica Section C 57(4) (2001) 480-482

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011847.cif $ #-------------------------------------------------------------------...

2,011,848

8.22

0.003

9.365

0.003

17.89

0.003

90

null

90

null

90

null

1,377.2

0.7

293

2

293

2

null

6

P 21 21 21

P 2ac 2ab

19

- C12 H14 Br F N2 O3 -

- C48 H56 Br4 F4 N8 O12 -

4

1

BK1579

Belin, Renaud; Tillard, Monique; Maurel, Jean-Louis; Ribet, Jean-Paul

Absolute configuration of (+)-(S)-2-(5-fluoro-2-methoxy-1,4-benzodioxan-2-yl)imidazolinium bromide

Acta Crystallographica Section C

2,001

57

4

483

484

10.1107/S0108270101000981

0.71069

MoKα

0.0881

0.0385

null

0.096

null

0.968

null

has coordinates

Belin, Renaud; Tillard, Monique; Maurel, Jean-Louis; Ribet, Jean-Paul Absolute configuration of (+)-(S)-2-(5-fluoro-2-methoxy-1,4-benzodioxan-2-yl)imidazolinium bromide Acta Crystallographica Section C 57(4) (2001) 483-484

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011848.cif $ #-------------------------------------------------------------------...

2,011,849

9.273

0.003

9.333

0.003

10.372

0.004

94.16

0.02

112.17

0.02

93.09

0.02

825.9

0.5

293

2

293

2

null

4

P -1

-P 1

2

Boc-Aib-Obzl

tert butyloxycarbonyl-α-aminoisobutyrate

- C16 H23 N O4 -

- C32 H46 N2 O8 -

2

1

BK1584

Leduc, Anne-Marie; Mashuta, Mark S.; Spatola, Arno F.

Benzyl tert-butoxycarbonyl-α-aminoisobutyrate

Acta Crystallographica Section C

2,001

57

4

487

488

10.1107/S010827010100110X

0.71073

MoKα

0.06

0.0481

null

0.1159

null

1.011

null

has coordinates

Leduc, Anne-Marie; Mashuta, Mark S.; Spatola, Arno F. Benzyl tert-butoxycarbonyl-α-aminoisobutyrate Acta Crystallographica Section C 57(4) (2001) 487-488

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011849.cif $ #-------------------------------------------------------------------...

2,011,850

7.4252

0.0008

9.4231

0.0007

9.4957

0.0009

64.253

0.002

74.117

0.002

88.504

0.002

572.28

0.09

293

2

293

2

null

5

P -1

-P 1

2

- C20 H16 Cl4 Cu4 N4 -

1

0.5

BM1430

Cui, Yong; Chen, Jiutong; Ren, Jing; Chen, Gang; Yu, Weichao; Qian, Yitai

Bis(2,2-bipyridine-N,N')tetra-μ-chloro-tetracopper(I)

Acta Crystallographica Section C

2,001

57

4

349

351

10.1107/S0108270100019855

0.71073

MoKα

0.0711

0.0551

null

0.1621

null

1.053

null

has coordinates

Cui, Yong; Chen, Jiutong; Ren, Jing; Chen, Gang; Yu, Weichao; Qian, Yitai Bis(2,2-bipyridine-N,N')tetra-μ-chloro-tetracopper(I) Acta Crystallographica Section C 57(4) (2001) 349-351

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/2/01/18/2011850.cif $ #-------------------------------------------------------------------...

2,011,851

9.764

0.003

11.006

0.002

19.78

0.003

97.56

0.02

102.29

0.02

101.73

0.02

1,999.3

0.8

293

2

293

2

null

5

P -1

-P 1

2

3',4'-Di-(p-chlorophenyl)-spiroisoxazoline-[5'.3]-4-chromanone

- C23 H15 Cl2 N O3 -

- C92 H60 Cl8 N4 O12 -

4

2

BM1437

Abdul Ajees, A.; Parthasarathy, S.; Manikandan, S.; Raghunathan, R.

3',4'-Bis(4-chlorophenyl)spiro[chroman-3,5'(4'H)-isoxazol]-4-one

Acta Crystallographica Section C

2,001

57

4

473

475

10.1107/S0108270101000920

1.5418

CuKα

0.1584

0.0479

null

0.1394

null

1.006

null

has coordinates,has Fobs

Abdul Ajees, A.; Parthasarathy, S.; Manikandan, S.; Raghunathan, R. 3',4'-Bis(4-chlorophenyl)spiro[chroman-3,5'(4'H)-isoxazol]-4-one Acta Crystallographica Section C 57(4) (2001) 473-475

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011851.cif $ #-------------------------------------------------------------------...

2,011,852

4.869

0.003

7.53

0.005

9.15

0.005

83.037

0.01

88.727

0.015

79.806

0.01

327.7

0.3

200

2

200

2

null

4

P -1

-P 1

2

1,4,8,11-tetraazacyclotetradecane-2,9-dione dihydrate

- C10 H24 N4 O4 -

1

0.5

BM1440

Hubin, Timothy J.; Tyryshkin, Nickolay; Alcock, Nathaniel W.; Busch, Daryle H.

trans-Dioxocyclam (1,4,8,11-tetraazacyclotetradecane-2,9-dione) dihydrate and its Ni^II^ complex

Acta Crystallographica Section C

2,001

57

4

359

362

10.1107/S0108270100020308

0.71073

MoKα

0.066

0.046

null

0.118

null

0.967

null

has coordinates,has Fobs

Hubin, Timothy J.; Tyryshkin, Nickolay; Alcock, Nathaniel W.; Busch, Daryle H. trans-Dioxocyclam (1,4,8,11-tetraazacyclotetradecane-2,9-dione) dihydrate and its Ni^II^ complex Acta Crystallographica Section C 57(4) (2001) 359-362

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/2/01/18/2011852.cif $ #-------------------------------------------------------------------...

2,011,853

20.861

0.003

7.3385

0.001

9.613

0.0013

90

null

112.205

0.002

90

null

1,362.5

0.3

180

2

180

2

null

5

C 1 2/c 1

-C 2yc

15

(1,4,8,11-tetraazacyclotetradecane-2,9-dione-κ^4^N)nickel(II) dihydrate

- C10 H22 N4 Ni O4 -

- C40 H88 N16 Ni4 O16 -

4

0.5

BM1440

Hubin, Timothy J.; Tyryshkin, Nickolay; Alcock, Nathaniel W.; Busch, Daryle H.

trans-Dioxocyclam (1,4,8,11-tetraazacyclotetradecane-2,9-dione) dihydrate and its Ni^II^ complex

Acta Crystallographica Section C

2,001

57

4

359

362

10.1107/S0108270100020308

0.71073

MoKα

0.107

0.06

null

0.153

null

1.04

null

has coordinates,has Fobs

Hubin, Timothy J.; Tyryshkin, Nickolay; Alcock, Nathaniel W.; Busch, Daryle H. trans-Dioxocyclam (1,4,8,11-tetraazacyclotetradecane-2,9-dione) dihydrate and its Ni^II^ complex Acta Crystallographica Section C 57(4) (2001) 359-362

301,798

2025-08-19

6:41:48

#------------------------------------------------------------------------------ #$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/2/01/18/2011853.cif $ #-------------------------------------------------------------------...

2,011,854

9.6413

0.0004

9.6413

0.0004

11.5935

0.0007

90

null

90

null

120

null

933.29

0.08

293

2

293

2

null

4

R -3 c :H

-R 3 2"c

167

Tristrontium cadmium platinum hexaoxide

- Cd O6 Pt Sr3 -

- Cd6 O36 Pt6 Sr18 -

6

0.166667

BR1306

Smith, Mark D.; zur Loye, Hans-Conrad

Sr~3~ZnPtO~6~ and Sr~3~CdPtO~6~

Acta Crystallographica Section C

2,001

57

4

337

338

10.1107/S0108270100020060

0.71073

MoKα

0.032

0.03

null

0.072

null

1.086

null

has coordinates,has Fobs

Smith, Mark D.; zur Loye, Hans-Conrad Sr~3~ZnPtO~6~ and Sr~3~CdPtO~6~ Acta Crystallographica Section C 57(4) (2001) 337-338

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/2/01/18/2011854.cif $ #-------------------------------------------------------------------...

2,011,855

9.6267

0.0007

9.6267

0.0007

11.2292

0.0011

90

null

90

null

120

null

901.23

0.13

293

2

293

2

null

4

R -3 c :H

-R 3 2"c

167

Tristrontium zinc platinum hexaoxide

- O6 Pt Sr3 Zn -

- O36 Pt6 Sr18 Zn6 -

6

0.166667

BR1306

Smith, Mark D.; zur Loye, Hans-Conrad

Sr~3~ZnPtO~6~ and Sr~3~CdPtO~6~

Acta Crystallographica Section C

2,001

57

4

337

338

10.1107/S0108270100020060

0.71073

MoKα

0.036

0.029

null

0.059

null

0.981

null

has coordinates,has Fobs

Smith, Mark D.; zur Loye, Hans-Conrad Sr~3~ZnPtO~6~ and Sr~3~CdPtO~6~ Acta Crystallographica Section C 57(4) (2001) 337-338

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/2/01/18/2011855.cif $ #-------------------------------------------------------------------...

2,011,856

16.703

0.003

3.634

0.001

20.248

0.003

90

null

117.38

0.01

90

null

1,091.3

0.4

295

2

295

2

null

5

P 1 21/c 1

-P 2ybc

14

4-(2-pyridylazo)-resorcinol

sodium 4-(2-pyridinylazo)-1,3-benzenediolate monohydrate

- C11 H10 N3 Na O3 -

- C44 H40 N12 Na4 O12 -

4

1

BR1310

Yatsenko, A. V.; Paseshnichenko, K. A.; Chernyshev, V. V.; Schenk, H.

Sodium 4-(2-pyridinyldiazenyl)resorcinolate monohydrate and ammonium 2,4-dinitro-1-naphthalenolate from powder diffraction data

Acta Crystallographica Section C

2,001

57

4

397

399

10.1107/S0108270101000014

1.5418

CuKα

null

2.14

null

has coordinates

Yatsenko, A. V.; Paseshnichenko, K. A.; Chernyshev, V. V.; Schenk, H. Sodium 4-(2-pyridinyldiazenyl)resorcinolate monohydrate and ammonium 2,4-dinitro-1-naphthalenolate from powder diffraction data Acta Crystallographica Section C 57(4) (2001) 397-399

199,684

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2017-08-09 18:13:17 +0300 (Wed, 09 Aug 2017) $ #$Revision: 199684 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/01/18/2011856.cif $ #-------------------------------------------------------------------...

2,011,857

3.924

0.001

20.314

0.004

13.336

0.003

90

null

94.31

0.01

90

null

1,060

0.4

295

2

295

2

null

4

P 1 21/c 1

-P 2ybc

14

Acid Yellow 24

ammonium 2,4-dinitro-1-naphthalenolate

- C10 H9 N3 O5 -

- C40 H36 N12 O20 -

4

1

BR1310

Yatsenko, A. V.; Paseshnichenko, K. A.; Chernyshev, V. V.; Schenk, H.

Sodium 4-(2-pyridinyldiazenyl)resorcinolate monohydrate and ammonium 2,4-dinitro-1-naphthalenolate from powder diffraction data

Acta Crystallographica Section C

2,001

57

4

397

399

10.1107/S0108270101000014

1.5418

CuKα

null

2.01

null

has coordinates

Yatsenko, A. V.; Paseshnichenko, K. A.; Chernyshev, V. V.; Schenk, H. Sodium 4-(2-pyridinyldiazenyl)resorcinolate monohydrate and ammonium 2,4-dinitro-1-naphthalenolate from powder diffraction data Acta Crystallographica Section C 57(4) (2001) 397-399

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/2/01/18/2011857.cif $ #-------------------------------------------------------------------...

2,011,858

3.878

0.001

3.878

null

11.818

0.002

90

null

90

null

90

null

177.73

0.05

297.2

null

4

P 4/m m m

-P 4 2

123

- Ba2 Cu3 O6.26 Sm -

1

0.0625

BR1311

Sato, Shoichi; Kino, Yoshihiro; Shibata, Atsushi; Nakamura, Masaru; Krauns, Christian; Shiohara, Yuh

Tetragonal SmBa~2~Cu~3~O~7{-~x} [x~=~0.74(4)]

Acta Crystallographica Section C

2,001

57

4

341

343

10.1107/S0108270100020242

0.7107

MoKα

null

0.019

null

0.026

null

1.594

null

has coordinates,has Fobs

Sato, Shoichi; Kino, Yoshihiro; Shibata, Atsushi; Nakamura, Masaru; Krauns, Christian; Shiohara, Yuh Tetragonal SmBa~2~Cu~3~O~7{-~x} [x~=~0.74(4)] Acta Crystallographica Section C 57(4) (2001) 341-343

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/2/01/18/2011858.cif $ #-------------------------------------------------------------------...

2,011,859

5.733

0.001

11.602

0.002

16.038

0.003

90

null

93.16

0.03

90

null

1,065.1

0.3

293

2

293

2

null

4

P 1 21/n 1

-P 2yn

14

trans-1-(4-aminophenyl)-2-phenyldiazene 2-oxide

- C12 H11 N3 O -

- C48 H44 N12 O4 -

4

1

DA1152

Domański, Andrzej; Ejsmont, Krzysztof; Kyzioł, Janusz B.; Zaleski, Jacek

Two trans-4-aminoazoxybenzenes

Acta Crystallographica Section C

2,001

57

4

467

470

10.1107/S0108270101000518

0.71073

MoKα

0.051

0.037

null

0.101

null

1.033

null

has coordinates,has Fobs

Domański, Andrzej; Ejsmont, Krzysztof; Kyzioł, Janusz B.; Zaleski, Jacek Two trans-4-aminoazoxybenzenes Acta Crystallographica Section C 57(4) (2001) 467-470

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/2/01/18/2011859.cif $ #-------------------------------------------------------------------...