Crystallography Open Database

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2016768 CIF
HKL
Paper
C14 H10 Ag Cl N4 O5P 1 21/n 18.5763; 13.4913; 14.1944
90; 103.37; 90
1597.86Niu, Cao-Yuan; Zheng, Xian-Fu; Bai, Ling-Ling; Wu, Xiao-Ling; Kou, Chun-Hong
A grid-like two-dimensional Ag^I^ coordination polymer: poly[[[μ~3~-<i>N</i>'-(4-cyanobenzylidene)isonicotinohydrazide]silver(I)] perchlorate]
Acta Crystallographica Section C, 2008, 64, m305-m307
2016769 CIF
HKL
Paper
C24 H16 Cl2 Mn N4 O4C 1 2/c 18.5272; 14.4503; 18.1776
90; 101.777; 90
2192.7Guan, Xiao-Hong; Wu, Jian-Zhong; Yu, Ying; Yang, Ping
<i>cis</i>-Dichloridobis(1,10-phenanthroline-5,6-diol-κ^2^<i>N</i>,<i>N</i>')manganese(II): a supramolecular chain formed <i>via</i> O—H···Cl bonds and aromatic stacking
Acta Crystallographica Section C, 2008, 64, m311-m313
2016770 CIF
HKL
Paper
C16 H13 Cl2 N OP n a 2111.9348; 21.617; 5.3024
90; 90; 90
1368Gómez, Sandra L.; Raysth, Walter; Palma, Alirio; Cobo, Justo; Low, John N.; Glidewell, Christopher
Three aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: hydrogen-bonded structures in two or three dimensions
Acta Crystallographica Section C, 2008, 64, o519-o523
2016771 CIF
HKL
Paper
C16 H13 Cl2 N OP 21 21 217.4328; 12.3746; 14.9187
90; 90; 90
1372.2Gómez, Sandra L.; Raysth, Walter; Palma, Alirio; Cobo, Justo; Low, John N.; Glidewell, Christopher
Three aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: hydrogen-bonded structures in two or three dimensions
Acta Crystallographica Section C, 2008, 64, o519-o523
2016772 CIF
HKL
Paper
C20 H16 Cl N OP 21 21 219.6174; 11.558; 13.465
90; 90; 90
1496.7Gómez, Sandra L.; Raysth, Walter; Palma, Alirio; Cobo, Justo; Low, John N.; Glidewell, Christopher
Three aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: hydrogen-bonded structures in two or three dimensions
Acta Crystallographica Section C, 2008, 64, o519-o523
2016773 CIF
HKL
Paper
C16 H15 Cu N4 O8 SP 1 21/c 111.124; 15.709; 11.337
90; 106.48; 90
1899.7Guo, Hong-Xu; Weng, Wen; Li, Xi-Zhong; Liang, Min; Zheng, Cai-Qing
A novel three-dimensional coordination polymer constructed from pyrazine and copper(I): poly[[copper(I)-di-μ~2~-pyrazine-κ^4^<i>N</i>:<i>N</i>'] 3,5-dicarboxybenzenesulfonate monohydrate]
Acta Crystallographica Section C, 2008, 64, m314-m316
2016774 CIF
HKL
Paper
C15 H15 Cl2 N O8P -16.7684; 6.9561; 18.0001
86.525; 87.481; 86.19
843.37Smith, Graham; Wermuth, Urs D.; White, Jonathan M.
Two- and three-dimensional hydrogen-bonded structures in the 1:1 proton-transfer compounds of 4,5-dichlorophthalic acid with the isomeric monoaminobenzoic acids
Acta Crystallographica Section C, 2008, 64, o532-o536
2016775 CIF
HKL
Paper
C15 H11 Cl2 N O6P 1 21/n 112.9028; 7.4091; 32.2323
90; 96.012; 90
3064.4Smith, Graham; Wermuth, Urs D.; White, Jonathan M.
Two- and three-dimensional hydrogen-bonded structures in the 1:1 proton-transfer compounds of 4,5-dichlorophthalic acid with the isomeric monoaminobenzoic acids
Acta Crystallographica Section C, 2008, 64, o532-o536
2016776 CIF
HKL
Paper
C15 H11 Cl2 N O6C 1 2/c 112.8552; 7.5003; 31.932
90; 94.785; 90
3068.1Smith, Graham; Wermuth, Urs D.; White, Jonathan M.
Two- and three-dimensional hydrogen-bonded structures in the 1:1 proton-transfer compounds of 4,5-dichlorophthalic acid with the isomeric monoaminobenzoic acids
Acta Crystallographica Section C, 2008, 64, o532-o536
2016777 CIF
HKL
Paper
C14 H14 Cl NP -18.213; 8.727; 9.042
90.5; 95.32; 113.86
589.4Novaković, Sladjana B.; Vitorović-Todorović, Maja D.; Bogdanović, Goran A.; Drakulić, Branko J.
Weak intermolecular interactions in 11-chloro-2,3,4,5-tetrahydro-1<i>H</i>-cyclohepta[<i>b</i>]quinoline
Acta Crystallographica Section C, 2008, 64, o502-o504
2016778 CIF
HKL
Paper
C19 H29 N OP 1 21 16.351; 42.306; 7.1764
90; 115.651; 90
1738.2Andrade, L. C. R.; Almeida, M. J. M. de; Fernandes Roleira, F. M.; Varela, C. L.; Tavares da Silva, E. J.
5α-Androst-3-en-17-one oxime
Acta Crystallographica Section C, 2008, 64, o508-o510
2016779 CIF
HKL
Paper
C16 H20 B2 F8 N4P 1 21/c 14.9517; 12.8674; 15.2828
90; 92.806; 90
972.58Ganesan, Kilivelu; Alias, Yatimah; Ng, Seik Weng
Imidazolium-based ionic liquid salts: 3,3'-dimethyl-1,1'-(1,4-phenylenedimethylene)diimidazolium bis(tetrafluoroborate) and 3,3'-di-<i>n</i>-butyl-1,1'-(1,4-phenylenedimethylene)diimidazolium bis(trifluoromethanesulfonate)
Acta Crystallographica Section C, 2008, 64, o478-o480
2016780 CIF
HKL
Paper
C24 H32 F6 N4 O6 S2P -110.3833; 12.047; 13.6933
100.752; 105.194; 111.97
1453.37Ganesan, Kilivelu; Alias, Yatimah; Ng, Seik Weng
Imidazolium-based ionic liquid salts: 3,3'-dimethyl-1,1'-(1,4-phenylenedimethylene)diimidazolium bis(tetrafluoroborate) and 3,3'-di-<i>n</i>-butyl-1,1'-(1,4-phenylenedimethylene)diimidazolium bis(trifluoromethanesulfonate)
Acta Crystallographica Section C, 2008, 64, o478-o480
2016781 CIF
HKL
Paper
C14 H19 N3P -16.8665; 9.4084; 11.147
91.611; 107.728; 111.097
632.22Portilla, Jaime; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher
2-<i>tert</i>-Butyl-5-methyl-7,8-dihydro-6<i>H</i>-cyclopenta[<i>e</i>]pyrazolo[1,5-<i>a</i>]pyrimidine: molecular stacks built from C—H···π(pyrazole) hydrogen bonds and π‒π stacking interactions
Acta Crystallographica Section C, 2008, 64, o471-o473
2016782 CIF
HKL
Paper
As3 F O12 Sr5P 63/m9.99; 9.99; 7.395
90; 90; 120
639.15Dordević, Tamara; Šutović, Sabina; Stojanović, Jovica; Karanović, Ljiljana
Sr, Ba and Cd arsenates with the apatite-type structure
Acta Crystallographica Section C, 2008, 64, i82-i86
2016783 CIF
HKL
Paper
As3 Ba2.95 Cl O12 Sr2.05P 63/m10.39; 10.39; 7.575
90; 90; 120
708.2Dordević, Tamara; Šutović, Sabina; Stojanović, Jovica; Karanović, Ljiljana
Sr, Ba and Cd arsenates with the apatite-type structure
Acta Crystallographica Section C, 2008, 64, i82-i86
2016784 CIF
HKL
Paper
As6 Cd10 Cl1.16 H0.84 O24.84P 63/m9.971; 9.971; 6.514
90; 90; 120
560.86Dordević, Tamara; Šutović, Sabina; Stojanović, Jovica; Karanović, Ljiljana
Sr, Ba and Cd arsenates with the apatite-type structure
Acta Crystallographica Section C, 2008, 64, i82-i86
2016785 CIF
HKL
Paper
C8 H10 O6 SP 1 21/c 118.497; 6.1203; 17.188
90; 112.051; 90
1803.5Pett, Virginia B.; Haynes, LeRoy W.
Conformation and hydrogen bonding for the bicyclic compound 3-thiabicyclo[3.2.0]heptane-6,7-dicarboxylic acid 3,3-dioxide
Acta Crystallographica Section C, 2008, 64, o485-o488
2016786 CIF
HKL
Paper
C14 H13 N3 O SP -110.6328; 11.1114; 12.8839
75.251; 65.652; 81.539
1339.56Rubčić, Mirta; Dilović, Ivica; Cindrić, Marina; Matković-Čalogović, Dubravka
Two thiosemicarbazones derived from salicylaldehyde: very specific hydrogen-bonding interactions of the N—H···S=C type
Acta Crystallographica Section C, 2008, 64, o570-o573
2016787 CIF
Paper
C15 H15 N3 O2 SP -14.73851; 11.3244; 14.0775
78.39; 89.547; 89.364
739.9Rubčić, Mirta; Dilović, Ivica; Cindrić, Marina; Matković-Čalogović, Dubravka
Two thiosemicarbazones derived from salicylaldehyde: very specific hydrogen-bonding interactions of the N—H···S=C type
Acta Crystallographica Section C, 2008, 64, o570-o573
2016788 CIF
HKL
Paper
C20 H28 Cd2 N4 O18P 1 21/c 110.572; 17.755; 7.39
90; 105.374; 90
1337.5Guo, Ming-Lin; Guo, Chen-Hu
Poly[[tetraaquabis(μ~2~-2-nitroterephthalato-κ^3^<i>O</i>^1^:<i>O</i>^4^,<i>O</i>^4'^)(μ~2~-piperazine-κ^3^<i>N</i>:<i>N</i>')dicadmium(II)] dihydrate]
Acta Crystallographica Section C, 2008, 64, m342-m344
2016789 CIF
HKL
Paper
C6 H18 Cl2 N2P 1 21/c 14.6042; 14.157; 15.6614
90; 89.327; 90
1020.77Blerk, Charmaine van; Kruger, Gert J.
Hydrogen-bonding motifs and thermotropic polymorphism in redetermined halide salts of hexamethylenediamine
Acta Crystallographica Section C, 2008, 64, o537-o542
2016790 CIF
HKL
Paper
C6 H18 Br2 N2P 1 21/c 14.7044; 14.4462; 16.2582
90; 90.115; 90
1104.92Blerk, Charmaine van; Kruger, Gert J.
Hydrogen-bonding motifs and thermotropic polymorphism in redetermined halide salts of hexamethylenediamine
Acta Crystallographica Section C, 2008, 64, o537-o542
2016791 CIF
HKL
Paper
C6 H18 I2 N2P 1 21/c 14.8884; 12.8756; 9.7488
90; 90.423; 90
613.58Blerk, Charmaine van; Kruger, Gert J.
Hydrogen-bonding motifs and thermotropic polymorphism in redetermined halide salts of hexamethylenediamine
Acta Crystallographica Section C, 2008, 64, o537-o542
2016792 CIF
HKL
Paper
C35 H46 Nb2 O Se2P 1 21/n 18.0288; 12.7685; 15.873
90; 92.848; 90
1625.2Hector, Andrew L.; Jura, Marek; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael
[{Cp~2~(^<i>t^</i>BuSe)Nb}~2~<i>E</i>] (<i>E</i> = O and Se) with bridging oxide or selenide ligands
Acta Crystallographica Section C, 2008, 64, m321-m323
2016793 CIF
HKL
Paper
C28 H38 Nb2 Se3C 1 2/c 131.583; 7.9548; 26.52
90; 121.29; 90
5694Hector, Andrew L.; Jura, Marek; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael
[{Cp~2~(^<i>t^</i>BuSe)Nb}~2~<i>E</i>] (<i>E</i> = O and Se) with bridging oxide or selenide ligands
Acta Crystallographica Section C, 2008, 64, m321-m323
2016794 CIF
HKL
Paper
C8 H11 N3 O5C 1 2/c 115.666; 6.6959; 18.726
90; 100.48; 90
1931.6Sridhar, Balasubramanian; Ravikumar, Krishnan
Supramolecular hydrogen-bonded networks in cytosinium succinate and cytosinium 4-nitrobenzoate cytosine monohydrate
Acta Crystallographica Section C, 2008, 64, o566-o569
2016795 CIF
HKL
Paper
C15 H17 N7 O7P -16.7154; 7.4036; 19.228
85.525; 87.576; 67.279
879Sridhar, Balasubramanian; Ravikumar, Krishnan
Supramolecular hydrogen-bonded networks in cytosinium succinate and cytosinium 4-nitrobenzoate cytosine monohydrate
Acta Crystallographica Section C, 2008, 64, o566-o569
2016796 CIF
HKL
Paper
C3 H7 NP 1 21/c 19.507; 9.122; 9.79
90; 117.469; 90
753.3Bond, Andrew D.; Davies, John E.; Parsons, Simon
Azetidine, pyrrolidine and hexamethyleneimine at 170K
Acta Crystallographica Section C, 2008, 64, o543-o546
2016797 CIF
HKL
Paper
C4 H9 NP 1 21/c 18.6753; 5.2078; 10.7108
90; 110.451; 90
453.41Bond, Andrew D.; Davies, John E.; Parsons, Simon
Azetidine, pyrrolidine and hexamethyleneimine at 170K
Acta Crystallographica Section C, 2008, 64, o543-o546
2016798 CIF
HKL
Paper
C6 H13 NP 1 21/n 111.0201; 10.3027; 12.7322
90; 114.11; 90
1319.5Bond, Andrew D.; Davies, John E.; Parsons, Simon
Azetidine, pyrrolidine and hexamethyleneimine at 170K
Acta Crystallographica Section C, 2008, 64, o543-o546
2016799 CIF
HKL
Paper
C24 H26 O4P b c a11.6394; 11.5736; 30.782
90; 90; 90
4146.6Cruz, Silvia; Quiroga, Jairo; Torre, José M. de la; Cobo, Justo; Low, John N.; Glidewell, Christopher
9-Benzoyl-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8-octahydroxanthene-1,8-dione: molecular conformation and supramolecular aggregation in xanthenediones
Acta Crystallographica Section C, 2008, 64, o554-o557
2016800 CIF
HKL
Paper
C26 H28 Cl2 Cu2 N6P -18.122; 8.412; 9.24
91.973; 93.386; 92.464
629.2Li, Rongqing; Zhao, Pusu; Tang, Guodong; Tang, Xiaoling
Di-μ-chlorido-bis({2-[1-(2-pyridylethylimino)ethyl]pyrrolato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}copper(II))
Acta Crystallographica Section C, 2008, 64, m339-m341
2016801 CIF
HKL
Paper
C9 H6 N12 S4 Zn4R 3 m :H13.9947; 13.9947; 8.4249
90; 90; 120
1428.97Park, Hyunsoo; Geiser, Urs; Halder, Gregory J.; Schlueter, John A.
Poly[μ~4~-sulfido-tris(thiocyanato-κ<i>N</i>)tris(μ~3~-1,2,4-triazolato-κ^3^<i>N</i>^1^:<i>N</i>^2^:<i>N</i>^4^)tetrazinc(II)]: a three-dimensional zinc sulfide coordination polymer
Acta Crystallographica Section C, 2008, 64, m327-m329
2016802 CIF
HKL
Paper
C42 H26 Cd2 Cl2 N8 O4P -110.069; 10.48; 10.749
88.59; 63.2; 73.59
964.2Kong, Zhi-Guo; Wang, Jia-Jun; Wang, Xiu-Yan
<i>catena</i>-Poly[[(2-phenyl-1<i>H</i>-1,3,7,8-tetraazacyclopenta[<i>l</i>]phenanthrene-κ^2^<i>N</i>^7^,<i>N</i>^8^)cadmium(II)]-di-μ-chlorido-[(2-phenyl-1<i>H</i>-1,3,7,8-tetraazacyclopenta[<i>l</i>]phenanthrene-κ^2^<i>N</i>^7^,<i>N</i>^8^)cadmium(II)]-μ-fumarato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^,<i>O</i>^4'^]: a coordination polymer with a two-dimensional supramolecular architecture
Acta Crystallographica Section C, 2008, 64, m333-m335
2016803 CIF
HKL
Paper
C16 H9 Cu2 N2 O5P 1 21/n 15.2011; 23.5553; 12.2402
90; 101.719; 90
1468.33Wang, Xiu-Yan; Wang, Jia-Jun
A mixed-valence copper coordination polymer generated by a hydrothermal metal/ligand redox reaction process
Acta Crystallographica Section C, 2008, 64, m330-m332
2016804 CIF
HKL
Paper
C8 H10 Br N OP -15.053; 9.4145; 9.5169
75.239; 89.253; 75.757
423.74Cinčić, Dominik; Kaitner, Branko
3-Acetylanilinium bromide, nitrate and dihydrogen phosphate: hydrogen-bonding motifs in one, two and three dimensions
Acta Crystallographica Section C, 2008, 64, o561-o565
2016805 CIF
HKL
Paper
C8 H10 N2 O4P n m a16.7754; 6.6044; 8.2683
90; 90; 90
916.06Cinčić, Dominik; Kaitner, Branko
3-Acetylanilinium bromide, nitrate and dihydrogen phosphate: hydrogen-bonding motifs in one, two and three dimensions
Acta Crystallographica Section C, 2008, 64, o561-o565
2016806 CIF
HKL
Paper
C8 H12 N O5 PP 1 21/c 14.6733; 10.5962; 21.1801
90; 93.631; 90
1046.72Cinčić, Dominik; Kaitner, Branko
3-Acetylanilinium bromide, nitrate and dihydrogen phosphate: hydrogen-bonding motifs in one, two and three dimensions
Acta Crystallographica Section C, 2008, 64, o561-o565
2016807 CIF
HKL
Paper
C14 H10 Cl2 N4 O4P 1 21/c 13.7294; 20.095; 9.6217
90; 98.8484; 90
712.49Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2/1) and 1,4-diazine‒chloranilic acid (2/1) determined at 110 K
Acta Crystallographica Section C, 2008, 64, o550-o553
2016808 CIF
HKL
Paper
C14 H10 Cl2 N4 O4P 1 21/n 13.753; 18.3915; 10.7248
90; 94.103; 90
738.36Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2/1) and 1,4-diazine‒chloranilic acid (2/1) determined at 110 K
Acta Crystallographica Section C, 2008, 64, o550-o553
2016809 CIF
HKL
Paper
C17 H11 Cl I N O SP 1 21/c 117.112; 7.636; 13.174
90; 111.29; 90
1603.9Rizvi, Umar Farooq; Siddiqui, Hamid Latif; Ahmad, Saeed; Ahmad, Matloob; Parvez, Masood
Novel chalcones derived from 2-chloro-3-formyl-6-methylquinoline
Acta Crystallographica Section C, 2008, 64, o547-o549
2016810 CIF
HKL
Paper
C18 H14 Cl N O2C 1 2/c 136.228; 7.372; 11.214
90; 99.7; 90
2952Rizvi, Umar Farooq; Siddiqui, Hamid Latif; Ahmad, Saeed; Ahmad, Matloob; Parvez, Masood
Novel chalcones derived from 2-chloro-3-formyl-6-methylquinoline
Acta Crystallographica Section C, 2008, 64, o547-o549
2016811 CIF
HKL
Paper
C78 H116 N4 O12 Rh2P 1 21/c 110.509; 33.708; 11.967
90; 111.388; 90
3947.2André, Vânia; Duarte, M. Teresa; Trindade, Alexandre F.; Góis, Pedro M. P.; Afonso, Carlos A. M.
Tetra-μ-acetato-bis{[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene]rhodium(II)}(<i>Rh</i>—<i>Rh</i>) tetrahydrofuran tetrasolvate
Acta Crystallographica Section C, 2008, 64, m345-m348
2016812 CIF
HKL
Paper
C26 H26 Co N4 O10P 1 21 17.0484; 19.4249; 10.3331
90; 109.774; 90
1331.33Şahin, Onur; Büyükgüngör, Orhan; Köse, Dursun Ali; Necefoglu, Hacali
<i>trans</i>-Diaquabis(nicotinamide-κ<i>N</i>)bis(salicylato-κ<i>O</i>)cobalt(II)
Acta Crystallographica Section C, 2008, 64, m317-m320
2016813 CIF
HKL
Paper
C17 H20 O5P n a 2123.2847; 12.1184; 5.5709
90; 90; 90
1571.96Langer, Vratislav; Li, Shiming; Lundquist, Knut
Conformation of 1-aryl-2-aryloxy-1-propanols: <i>threo</i>-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1-propanol
Acta Crystallographica Section C, 2008, 64, o558-o560
2016814 CIF
HKL
Paper
C29 H38 Cu N8 O8P -112.2286; 12.4976; 12.951
103.759; 98.726; 118.767
1600.8Dai, Yu-Mei; Tang, En; Huang, Jin-Feng; Yang, Qiu-Yan
Poly[[sesqui[μ~2~-1,4-bis(imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>'](carbonato-κ^2^<i>O</i>,<i>O</i>')copper(II)] 1,4-bis(imidazol-1-ylmethyl)benzene hemisolvate pentahydrate]
Acta Crystallographica Section C, 2008, 64, m349-m352
2016815 CIF
HKL
Paper
C33 H26 N2 O2P -110.9251; 11.777; 11.9438
90.417; 112.616; 112.75
1286.1Rodríguez, Ricuarte; Nogueras, Manuel; Low, John N.; Cobo, Justo; Glidewell, Christopher
(1<i>RS</i>,2<i>SR</i>,3<i>RS</i>,5<i>SR</i>)-2-Benzoyl-4,4-dicyano-1,3,5-triphenylcyclohexanol at 120K: complex sheets built from C—H···O and C—H···N hydrogen bonds
Acta Crystallographica Section C, 2008, 64, o578-o582
2016816 CIF
HKL
Paper
C28 H26 Cu2 N6 O14C 1 2/c 113.815; 12.109; 18.787
90; 106.55; 90
3013Yin, Hua
The new three-dimensional supramolecule bis{μ-2-[(4-hydroxybenzoyl)hydrazonomethyl]phenolato}bis[aquacopper(II)] dinitrate
Acta Crystallographica Section C, 2008, 64, m324-m326
2016817 CIF
HKL
Paper
C19 H13 N5 O2P 1 21 19.032; 11.758; 9.208
90; 117.11; 90
870.4Mazur, Liliana; Koziol, Anna E.; Modzelewska-Banachiewicz, Bozena
2-[4-Phenyl-5-(2-pyridyl)-4<i>H</i>-1,2,4-triazol-3-yl]nicotinic acid: a case of solvent-dependent polymorphism
Acta Crystallographica Section C, 2008, 64, o574-o577

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