Crystallography Open Database

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4517099 CIFC14 H10 Cl N O2A 13.9241; 25.9438; 24.4694
90; 93.228; 90
2487.18Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517102 CIFC14 H10 Cl N O2A 13.9264; 25.9494; 24.4668
90; 93.232; 90
2488.9Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517105 CIFC14 H10 Cl N O2A 13.9228; 25.8422; 24.3992
90; 93.242; 90
2469.48Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517108 CIFC14 H10 Cl N O2A 13.9232; 25.922; 24.4016
90; 93.232; 90
2477.6Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517111 CIFC14 H10 Cl N O2A 13.91134; 25.8622; 24.361
90; 93.2477; 90
2460.3Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517114 CIFC14 H10 Cl N O2A 13.9204; 25.9196; 24.4008
90; 93.2666; 90
2475.46Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517117 CIFC14 H10 Cl N O2A 13.92123; 25.92522; 24.41148
90; 93.2666; 90
2477.61Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517120 CIFC14 H10 Cl N O2A 13.91837; 25.91518; 24.41244
90; 93.2678; 90
2474.94Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4517123 CIFC14 H10 Cl N O2A 13.91748; 25.90664; 24.3985
90; 93.2528; 90
2472.18Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat
Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction
Crystal Growth & Design, 2010, 10, 52
4504081 CIFC38 H38 N8 O6A 1 2/a 119.704; 7.299; 25.698
90; 108.3; 90
3509Wang, Wen-Hai; Xi, Pei-Hua; Su, Xiao-Yu; Lan, Jing-Bo; Mao, Zhi-Hua; You, Jing-Song; Xie, Ru-Gang
Supramolecular Assemblies of Multifunctional Diimidazole and Dicarboxylic Acids via Various Hydrogen Bonds and X···π (X = π, CH) Interactions
Crystal Growth & Design, 2007, 7, 741
4505350 CIFC6 H13 Cl2 Cu Hg N5A 1 2/a 115.7274; 8.6102; 19.2642
90; 97.735; 90
2584.9Draper, Neil D.; Batchelor, Raymond J.; Leznoff, Daniel B.
Tuning the Structures of Mercury Cyanide-Based Coordination Polymers with Transition Metal Cations
Crystal Growth & Design, 2004, 4, 621
4501048 CIFC11 H12 O3A b a 211.512; 11.456; 7.1028
90; 90; 90
936.7Mehta, Goverdhan; Sen, Saikat
Interesting Modes of Self-assembly of Achiral 12-Oxo-11,13-dioxa[4.4.3]propellanes in a Noncentrosymmetric Environment
Crystal Growth & Design, 2011, 11, 3721
4502480 CIFC12 H11 Ag N4 O4A b a 218.0934; 12.9305; 10.9566
90; 90; 90
2563.4Kundu, Nabanita; Audhya, Anandalok; Abtab, Sk Md Towsif; Ghosh, Sanjib; Tiekink, Edward R. T.; Chaudhury, Muktimoy
Anion-Controlled Assembly of Silver(I) Complexes of Multiring Heterocyclic Ligands: A Structural and Photophysical Study
Crystal Growth & Design, 2010, 10, 1269
4503852 CIFC22 H18 F2 N2 O2A b a 213.82; 15.563; 8.985
90; 90; 90
1932Kato, Takako; Okamoto, Iwao; Masu, Hyuma; Katagiri, Kosuke; Tominaga, Masahide; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Azumaya, Isao
Polymorphism and Pseudopolymorphism of an Aromatic Amide: Spontaneous Resolution and Crystal-to-Crystal phase Transition
Crystal Growth & Design, 2008, 8, 3871
4503853 CIFC22 H18 F2 N2 O2A b a 217.8296; 7.4296; 13.5221
90; 90; 90
1791.2Kato, Takako; Okamoto, Iwao; Masu, Hyuma; Katagiri, Kosuke; Tominaga, Masahide; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Azumaya, Isao
Polymorphism and Pseudopolymorphism of an Aromatic Amide: Spontaneous Resolution and Crystal-to-Crystal phase Transition
Crystal Growth & Design, 2008, 8, 3871
4503855 CIFC22.5 H19 Cl F2 N2 O2A b a 228.459; 8.9853; 15.4982
90; 90; 90
3963.1Kato, Takako; Okamoto, Iwao; Masu, Hyuma; Katagiri, Kosuke; Tominaga, Masahide; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Azumaya, Isao
Polymorphism and Pseudopolymorphism of an Aromatic Amide: Spontaneous Resolution and Crystal-to-Crystal phase Transition
Crystal Growth & Design, 2008, 8, 3871
4504229 CIFC12 H11 Ag N4 O4A b a 218.125; 13.0397; 11.0126
90; 90; 90
2602.8Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong
Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands
Crystal Growth & Design, 2007, 7, 2481
4504272 CIFC40 H22 Mn N8 O4A b a 215.4071; 20.45; 9.9044
90; 90; 90
3120.6Wei, Yongqin; Yu, Yunfang; Wu, Kechen
Highly Stable Diamondoid Network Coordination Polymer [Mn(NCP)2]nwith Notable NLO, Magnetic, and Luminescence Properties
Crystal Growth & Design, 2007, 7, 2262
4504735 CIFC11 H10 N4 OA b a 213.8; 6.999; 9.992
90; 90; 90
965.1Custelcean, Radu; Moyer, Bruce A.; Bryantsev, Vyacheslav S.; Hay, Benjamin P.
Anion Coordination in Metal−Organic Frameworks Functionalized with Urea Hydrogen-Bonding Groups
Crystal Growth & Design, 2006, 6, 555
4504801 CIFC11 H10 N4 OA b a 213.707; 7.014; 10.006
90; 90; 90
962Reddy, L. Sreenivas; Basavoju, Srinivas; Vangala, Venu R.; Nangia, Ashwini
Hydrogen Bonding in Crystal Structures ofN,N‘-Bis(3-pyridyl)urea. Why Is the N−H···O Tape Synthon Absent in Diaryl Ureas with Electron-Withdrawing Groups?
Crystal Growth & Design, 2006, 6, 161
4505207 CIFC15 H26 Cl N3A b a 211.978; 37.836; 14.948
90; 90; 90
6774Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin
Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides
Crystal Growth & Design, 2005, 5, 1881
4505573 CIFC14 H12 In N5 O8A b a 212.928; 10.806; 12.262
90; 90; 90
1713Cepeda, Javier; Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; Pérez-Yáñez, Sonia; Román, Pascual
Structure-Directing Effect of Organic Cations in the Assembly of Anionic In(III)/Diazinedicarboxylate Architectures
Crystal Growth & Design, 2012, 12, 1501
4508601 CIFC50 H50 N8 Ni O8A b a 219.562; 15.8621; 15.3525
90; 90; 90
4763.8Goswami, Arijit; Bala, Sukhen; Pachfule, Pradip; Mondal, Raju
Comprehensive Study on Mutual Interplay of Multiple V-Shaped Ligands on the Helical Nature of a Series of Coordination Polymers and Their Properties
Crystal Growth & Design, 2013, 13, 5487
4509067 CIFC68 H42 Co5 N18 O5A b a 217.9653; 19.8784; 17.6947
90; 90; 90
6319.2Mo, Hao-Jun; Zhong, Yong-Rui; Cao, Man-Li; Ou, Yong-Cong; Ye, Bao-Hui
Hydrothermal Syntheses and Structural Diversity of Cobalt Complexes with 2,2′-Bibenzimidazole Ligand by Temperature Tuning Strategy
Crystal Growth & Design, 2009, 9, 488
4509651 CIFC23 H27 N4 O5 SA b a 213.1383; 27.585; 12.4518
90; 90; 90
4512.8Soegiarto, Airon C.; Ward, Michael D.
Directed Organization of Dye Aggregates in Hydrogen-Bonded Host Frameworks
Crystal Growth & Design, 2009, 9, 3803
4509695 CIFC16 H24 Cd N6 O5A b a 217.212; 13.6942; 18.955
90; 90; 90
4467.8Liang, Xiao-Qiang; Li, Dong-Ping; Zhou, Xin-Hui; Sui, Yan; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng
Metal−Organic Coordination Polymers Generated from Chiral Camphoric Acid and Flexible Ligands with Different Spacer Lengths: Syntheses, Structures, and Properties
Crystal Growth & Design, 2009, 9, 4872
4510445 CIFC30 H41 Ag2 N10 O4A b a 223.326; 32.24; 9.8621
90; 90; 90
7416.6Han, Lu-Lu; Zhang, Xi-Ying; Chen, Jiang-Shan; Li, Zhong-Hui; Sun, Dao-Feng; Wang, Xing-Po; Sun, Di
Silver(I)/Bipyrazole/Dicarboxylate Interpenetrated Coordination Networks: Spontaneous Chiral Resolution, Modulation of Topologies, Water Clusters, and Photoluminescences
Crystal Growth & Design, 2014, 14, 2230
4510446 CIFC31 H43 Ag2 N10 O4A b a 222.712; 34.599; 9.858
90; 90; 90
7747Han, Lu-Lu; Zhang, Xi-Ying; Chen, Jiang-Shan; Li, Zhong-Hui; Sun, Dao-Feng; Wang, Xing-Po; Sun, Di
Silver(I)/Bipyrazole/Dicarboxylate Interpenetrated Coordination Networks: Spontaneous Chiral Resolution, Modulation of Topologies, Water Clusters, and Photoluminescences
Crystal Growth & Design, 2014, 14, 2230
4510551 CIFC15 H14 N4 O3A b a 214.5908; 9.3764; 10.3283
90; 90; 90
1413.01Rubčić, Mirta; Galić, Nives; Halasz, Ivan; Jednačak, Tomislav; Judaš, Nenad; Plavec, Janez; Šket, Primož; Novak, Predrag
Multiple Solid Forms of 1,5-Bis(salicylidene)carbohydrazide: Polymorph-Modulated Thermal Reactivity
Crystal Growth & Design, 2014, 14, 2900
4511676 CIFC9 H10 Cd N2 O6A b a 221.9763; 10.4278; 10.7628
90; 90; 90
2466.45Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Zelentsov, Vyacheslav I.; Datsko, Tatiana Ya.; Fonari, Marina S.
Polymeric Luminescent Zn(II) and Cd(II) Dicarboxylates Decorated by Oxime Ligands: Tuning the Dimensionality and Adsorption Capacity
Crystal Growth & Design, 2014, 14, 3935
4501754 CIFC29 H25 Ce N9 O16A e a 215.9668; 17.7252; 11.5612
90; 90; 90
3271.99Das, Babulal; Baruah, Jubaraj B.
Protonated Adenine and Cytosine Ribbons Stabilized by Dipicolinato Metal Frameworks
Crystal Growth & Design, 2010, 10, 3242
4517089 CIFC9 H14 Ag2 N3 O4 PA e m 27.1411; 12.8457; 14.2823
90; 90; 90
1310.2Jaros, Sabina W.; Guedes da Silva, M. Fátima C.; Florek, Magdalena; Oliveira, M. Conceição; Smoleński, Piotr; Pombeiro, Armando J. L.; Kirillov, Alexander M.
Aliphatic Dicarboxylate Directed Assembly of Silver(I) 1,3,5-Triaza-7-phosphaadamantane Coordination Networks: Topological Versatility and Antimicrobial Activity
Crystal Growth & Design, 2014, 14, 5408
4504445 CIFC6 H4 Cu2 N2 S2A m a 27.3433; 8.5921; 12.889
90; 90; 90
813.2Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang
Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions
Crystal Growth & Design, 2007, 7, 2352
4507351 CIFC11 H6 Br N2 O5 ZnA m a 212.8977; 8.1974; 11.2059
90; 90; 90
1184.77Zhang, Yu; Guo, Beibei; Li, Li; Liu, Shaofeng; Li, Gang
Construction and Properties of Six Metal‒Organic Frameworks Based on the Newly Designed 2-(p-Bromophenyl)-Imidazole Dicarboxylate Ligand
Crystal Growth & Design, 2013, 13, 367
4512830 CIFC3 H Cl3 N2A m a 29.9264; 16.0761; 3.8161
90; 90; 90
608.96Andrzejewski, Michał; Marciniak, Jędrzej; Rajewski, Kacper W.; Katrusiak, Andrzej
Halogen and Hydrogen Bond Architectures in Switchable Chains of Di- and Trihaloimidazoles
Crystal Growth & Design, 2015, 15, 1658
4512831 CIFC3 H Br3 N2A m a 210.1305; 16.7094; 4.0483
90; 90; 90
685.27Andrzejewski, Michał; Marciniak, Jędrzej; Rajewski, Kacper W.; Katrusiak, Andrzej
Halogen and Hydrogen Bond Architectures in Switchable Chains of Di- and Trihaloimidazoles
Crystal Growth & Design, 2015, 15, 1658
4513025 CIFC26 H33 N O6A m a 213.8342; 22.8608; 7.8578
90; 90; 90
2485.11Drużbicki, Kacper; Mielcarek, Jadwiga; Kiwilsza, Anna; Toupet, Loic; Collet, Eric; Pajzderska, Aleksandra; Wąsicki, Jan
Computationally Assisted (Solid-State Density Functional Theory) Structural (X-ray) and Vibrational Spectroscopy (FT-IR, FT-RS, TDs-THz) Characterization of the Cardiovascular Drug Lacidipine
Crystal Growth & Design, 2015, 15, 2817
4511756 CIFAs K O3B -19.192; 10.285; 11.992
105.74; 90; 103.69
1057.7Stöger, Berthold; Dušek, Michal
Complex Polymorphism and Polytypism of Potassium Metaarsenate, KAsO3
Crystal Growth & Design, 2014, 14, 4640
4511757 CIFAs K0.798 O3 Rb0.202B -19.0742; 10.2593; 12.007
105.375; 90.02; 104.188
1042.4Stöger, Berthold; Dušek, Michal
Complex Polymorphism and Polytypism of Potassium Metaarsenate, KAsO3
Crystal Growth & Design, 2014, 14, 4640
4505247 CIFC10 H24 Fe N2 O13B 1 21 114.521; 14.229; 68.443
90; 96.26; 90
14057.3Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt
[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†
Crystal Growth & Design, 2005, 5, 2225
4505241 CIFC10 H24 Mn N2 O13C -114.544; 28.47; 10.646
89.78; 126.43; 89.98
3547Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt
[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†
Crystal Growth & Design, 2005, 5, 2225
4505242 CIFC10 H24 Mn N2 O13C -114.73; 28.329; 10.786
89.95; 126.05; 90.05
3639Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt
[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†
Crystal Growth & Design, 2005, 5, 2225
9017412 CIFC Ca O3C 112.353; 7.102; 25.733
90.46; 99.78; 90.24
2224.67Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R.
The multiple structures of vaterite
Crystal Growth & Design, 2013, 13, 2247-2251
9017413 CIFC Ca O3C 112.358; 7.106; 25.741
90.43; 99.88; 90.29
2226.84Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R.
The multiple structures of vaterite
Crystal Growth & Design, 2013, 13, 2247-2251
4500148 CIFC24 H30 Ca3 N2 O19C 1 2 116.614; 13.1785; 15.63
90; 91.528; 90
3420.9Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav
Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations
Crystal Growth & Design, 2011, 11, 699
4500167 CIFC27 H31 Cd N9 O11C 1 2 127.042; 15.42; 8.98
90; 104.943; 90
3617.9Yao, Xiao-Qiang; Cao, Da-Peng; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen
Chiral and Porous Coordination Polymers Based on an N-Centered Triangular Rigid Ligand
Crystal Growth & Design, 2011, 11, 231
4500895 CIFC35 H45 N9 O14 S2 Zn2C 1 2 120.971; 9.2303; 11.4429
90; 110.431; 90
2075.6Croitor, Lilia; Coropceanu, Eduard B.; Siminel, Anatolii V.; Kravtsov, Victor Ch.; Fonari, Marina S.
Polymeric Zn(II) and Cd(II) Sulfates with Bipyridine and Dioxime Ligands: Supramolecular Isomerism, Chirality, and Luminescence
Crystal Growth & Design, 2011, 11, 3536
4500907 CIFB11 Li6 O22 Rb5C 1 2 111.6252; 7.101; 13.7442
90; 106.871; 90
1085.76Yang, Yun; Pan, Shilie; Han, Jian; Hou, Xueling; Zhou, Zhongxiang; Zhao, Wenwu; Chen, Zhaohui; Zhang, Min
A New Lithium Rubidium Borate Li6Rb5B11O22with Isolated B11O22Building Blocks
Crystal Growth & Design, 2011, 11, 3912
4501214 CIFC24 H53 Fe4 Na7 O58 Sb6C 1 2 116.8704; 21.2935; 9.5632
90; 120.011; 90
2974.8Gao, Qiang; Wang, Xiqu; Conato, Marlon T.; Makarenko, Tatyana; Jacobson, Allan J.
Microporous, Homochiral Structures Containing Iron Oxo-Clusters Supported by Antimony(III) Tartrate Scaffolds
Crystal Growth & Design, 2011, 11, 4632
4501242 CIFC34 H30 Cd N4 O5C 1 2 121.421; 11.107; 15.888
90; 126.51; 90
3038.3Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting
Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties
Crystal Growth & Design, 2011, 11, 4667

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