Crystallography Open Database
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Searching space group like 'P b c n'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7209982 | CIF | C18 H18 Mn2 N14 O4 | P b c n | 23.746; 12.946; 15.957 90; 90; 90 | 4905 | Dong, Wen-Wen; Li, Dong-Sheng; Zhao, Jun; Ma, Lu-Fang; Wu, Ya-Pan; Duan, Ya-Ping Two solvent-dependent manganese(ii) supramolecular isomers: solid-state transformation and magnetic properties CrystEngComm, 2013, 15, 5412 |
| 7210046 | CIF | C23 H20 Cu2 N10 O15 | P b c n | 16.2118; 16.2381; 22.4507 90; 90; 90 | 5910.1 | Yang, Yan; Du, Peng; Yang, Jin; Kan, Wei-Qiu; Ma, Jian-Fang A series of Cu(ii) and Cd(ii) coordination polymers constructed by 3,5-dinitrosalicylic acid and flexible bis(triazole) ligands containing different spacers CrystEngComm, 2013, 15, 4357 |
| 7210088 | CIF | C12 H12 N4 O | P b c n | 10.353; 12.3146; 9.4233 90; 90; 90 | 1201.41 | Fahsi, Karim; Deschamps, Jérôme; Chougrani, Kamel; Viau, Lydie; Boury, Bruno; Vioux, André; van der Lee, Arie; Dutremez, Sylvain G. Stability and solid-state polymerization reactivity of imidazolyl- and benzimidazolyl-substituted diacetylenes: pivotal role of lattice water CrystEngComm, 2013, 15, 4261 |
| 7210213 | CIF | C28 H28 N10 O4 | P b c n | 31.5; 12.412; 7.016 90; 90; 90 | 2743.1 | Delori, Amit; Suresh, Eringathodi; Pedireddi, V. R. Influence of molecular shape on the design and synthesis of supramolecular assemblies CrystEngComm, 2013, 15, 4811 |
| 7210238 | CIF | C3.05 H2.29 N1.52 O0.57 Zn0.19 | P b c n | 10.232; 14.433; 22.709 90; 90; 90 | 3353.6 | Liu, Zhi-Fa; Wu, Mei-Feng; Zheng, Fa-Kun; Wang, Shuai-Hua; Zhang, Ming-Jian; Chen, Jun; Xiao, Yu; Guo, Guo-Cong; Wu, A-Qing Zinc(ii) coordination compounds based on in situ generated 3-(5H-tetrazol)benzaldehyde with diverse modes: hydrothermal syntheses, crystal structures and photoluminescent properties CrystEngComm, 2013, 15, 7038 |
| 7210410 | CIF | C53 H37.93 K0.69 N O12.31 Ru S32 | P b c n | 10.3683; 19.6056; 36.0834 90; 90; 90 | 7334.9 | Prokhorova, Tatiana G.; Zorina, Leokadiya V.; Simonov, Sergey V.; Zverev, Vladimir N.; Canadell, Enric; Shibaeva, Rimma P.; Yagubskii, Eduard B. The first molecular superconductor based on BEDT-TTF radical cation salt with paramagnetic tris(oxalato)ruthenate anion CrystEngComm, 2013, 15, 7048 |
| 7210442 | CIF | C13 H12 Cu N2 O8 | P b c n | 16.2119; 10.9173; 15.7225 90; 90; 90 | 2782.73 | Patra, Ranjan; Titi, Hatem M.; Goldberg, Israel 1D, 2D and 3D coordination polymers of 5,5′-methylenebis(oxy)dinicotinic acid with Co(ii), Mn(ii), Cu(ii) and Cd(ii) ions CrystEngComm, 2013, 15, 7257 |
| 7210465 | CIF | C18 H20 N8 S4 | P b c n | 16.357; 10.062; 13.506 90; 90; 90 | 2222.9 | Avasthi, Kamlakar; Ansari, Amantullah; Kant, Ruchir; Maulik, Prakas R.; Ravikumar, Krishnan; Chattopadhyay, Partha; Adhikary, Nirmal D. An alternative to ‘propylene/Leonard linker’ for studying arene interactions in flexible pyrazolo[3,4-d]pyrimidine core based models both at molecular and supramolecular levels CrystEngComm, 2011, 13, 2039 |
| 7210623 | CIF | C32 H22 Cd N6 O5 | P b c n | 13.1218; 20.9009; 20.6305 90; 90; 90 | 5658.1 | Yuan, Fei; Xie, Juan; Hu, Huai-Ming; Yuan, Chun-Mei; Xu, Bing; Yang, Meng-Lin; Dong, Fa-Xin; Xue, Gang-Lin Effect of pH/metal ion on the structure of metal‒organic frameworks based on novel bifunctionalized ligand 4′-carboxy-4,2′:6′,4′′-terpyridine CrystEngComm, 2013, 15, 1460 |
| 7210840 | CIF | C57 H52 O8 | P b c n | 27.539; 7.4754; 25.6914 90; 90; 90 | 5289 | Chaumont, Clément; Mobian, Pierre; Kyritsakas, Nathalie; Henry, Marc Synthesis, topology and energy analysis of crystalline resorcinol-based oligophenylene molecules with various symmetries CrystEngComm, 2013, 15, 6845 |
| 7210894 | CIF | C27 H46 Co8 N18 O33 | P b c n | 13.739; 24.301; 15.179 90; 90; 90 | 5067.8 | Calahorro, Antonio J.; Salinas-Castillo, Alfonso; Seco, José Manuel; Zuñiga, Javier; Colacio, Enrique; Rodríguez-Diéguez, Antonio Luminescence and magnetic properties of three metal‒organic frameworks based on the 5-(1H-tetrazol-5-yl)isophthalic acid ligand CrystEngComm, 2013, 15, 7636 |
| 7210970 | CIF | C13 H15 Cl N2 O2 | P b c n | 18.043; 7.0446; 20.792 90; 90; 90 | 2642.8 | Trzybiński, Damian; Sikorski, Artur Solvent-bridged frameworks of hydrogen bonds in crystals of 9-aminoacridinium halides CrystEngComm, 2013, 15, 6808 |
| 7211094 | CIF | C32 H38 N10 O18 Zn3 | P b c n | 23.908; 10.0503; 17.068 90; 90; 90 | 4101.1 | Zhang, Xiaoxi; Xing, Na; Bai, Fengying; Wan, Lijuan; Shan, Hui; Hou, Yanan; Xing, Yongheng; Shi, Zhan Multi-functional d10 metal–organic materials based on bis-pyrazole/pyridine ligands supported by a 2,6-di(3-pyrazolyl)pyridine with different spanning flexible dicarboxylate ligands: synthesis, structure, photoluminescent and catalytic properties CrystEngComm, 2013, 15, 9135 |
| 7211119 | CIF | C14 H11 Cs O4 | P b c n | 28.3393; 7.0215; 6.9066 90; 90; 90 | 1374.31 | Rees, Gregory J.; Day, Stephen P.; Lari, Alberth; Howes, Andrew P.; Iuga, Dinu; Pitak, Mateusz B.; Coles, Simon J.; Threlfall, Terry L.; Light, Mark E.; Smith, Mark E.; Quigley, David; Wallis, John D.; Hanna, John V. A multinuclear solid state NMR, density functional theory and X-Ray diffraction study of hydrogen bonding in Group I hydrogen dibenzoates CrystEngComm, 2013, 15, 8823 |
| 7211255 | CIF | C58 H74 N2 O14 | P b c n | 33.4782; 9.1734; 17.5749 90; 90; 90 | 5397.4 | Sekiya, Ryo; Yamasaki, Yutaro; Katayama, Susumu; Shio, Hidemi; Haino, Takeharu Head-to-tail polymeric columnar structure of calix[4]arene possessing catechol arms in the solid state CrystEngComm, 2013, 15, 8404 |
| 7211489 | CIF | C15 H23 Cd2 N9 O15 S2 | P b c n | 23.8424; 14.7858; 7.6296 90; 90; 90 | 2689.65 | Safin, Damir A.; Xu, Yang; Korobkov, Ilia; Bryce, David L.; Murugesu, Muralee Renaissance of the coordination chemistry of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (TPymT). Part I: First crystal structure of a TPymT complex with a d-metal cation CrystEngComm, 2013, 15, 10419 |
| 7211917 | CIF | C14 H14 Cu O6 | P b c n | 16.1983; 14.3762; 12.8497 90; 90; 90 | 2992.3 | Kanoo, Prakash; Gurunatha, K. L.; Maji, Tapas Kumar Versatile functionalities in MOFs assembled from the same building units: interplay of structural flexibility, rigidity and regularity Journal of Materials Chemistry, 2010, 20, 1322 |
| 7211977 | CIF | C62 H32 Cu2 F12 N5 O10 | P b c n | 16.389; 13.157; 26.553 90; 90; 90 | 5726 | Pachfule, Pradip; Dey, Chandan; Panda, Tamas; Banerjee, Rahul Synthesis and structural comparisons of five new fluorinated metal organic frameworks (F-MOFs) CrystEngComm, 2010, 12, 1600 |
| 7212136 | CIF | C23 H28 N8 | P b c n | 16.807; 16.647; 7.6875 90; 90; 90 | 2150.9 | Xue, Fumin; Ma, Yan; Fu, Limin; Hao, Rui; Shao, Guangsheng; Tang, Minxian; Zhang, Jianping; Wang, Yuan A europium complex with enhanced long-wavelength sensitized luminescent properties. Physical chemistry chemical physics : PCCP, 2010, 12, 3195-3202 |
| 7212154 | CIF | C34 H52 N12 O12 S Zn | P b c n | 12.61; 23.552; 14.121 90; 90; 90 | 4193.8 | Wu, Biao; Liang, Jianjun; Zhao, Yuxin; Li, Minrui; Li, Shaoguang; Liu, Yanyan; Zhang, Yongping; Yang, Xiao-Juan Sulfate encapsulation in three-fold interpenetrated metal‒organic frameworks with bis(pyridylurea) ligands CrystEngComm, 2010, 12, 2129 |
| 7212155 | CIF | C34 H52 Cd N12 O12 S | P b c n | 12.7357; 23.931; 14.2117 90; 90; 90 | 4331.4 | Wu, Biao; Liang, Jianjun; Zhao, Yuxin; Li, Minrui; Li, Shaoguang; Liu, Yanyan; Zhang, Yongping; Yang, Xiao-Juan Sulfate encapsulation in three-fold interpenetrated metal‒organic frameworks with bis(pyridylurea) ligands CrystEngComm, 2010, 12, 2129 |
| 7212156 | CIF | C36 H56 N12 O12 S Zn | P b c n | 13.1181; 23.502; 14.1772 90; 90; 90 | 4370.9 | Wu, Biao; Liang, Jianjun; Zhao, Yuxin; Li, Minrui; Li, Shaoguang; Liu, Yanyan; Zhang, Yongping; Yang, Xiao-Juan Sulfate encapsulation in three-fold interpenetrated metal‒organic frameworks with bis(pyridylurea) ligands CrystEngComm, 2010, 12, 2129 |
| 7212194 | CIF | C18.5 H18.5 Mn N3.5 O6.5 | P b c n | 18.733; 10.2319; 20.283 90; 90; 90 | 3887.7 | Chen, Man-Sheng; Bai, Zheng-Shuai; Okamura, Taka-aki; Su, Zhi; Chen, Shui-Sheng; Sun, Wei-Yin; Ueyama, Norikazu Metal‒organic frameworks with pyridyl- and carboxylate-containing ligands: syntheses, structures and properties CrystEngComm, 2010, 12, 1935 |
| 7212227 | CIF | C15 H26 Cu N4 O5 | P b c n | 15.6709; 10.8951; 11.3147 90; 90; 90 | 1931.8 | Garau, Federica; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio; Venzo, Alfonso Crystal structure, supramolecular assembly and preliminary reactivity behaviour of new heteropolytopic ligands based on oxalate/malonate skeleton and azolate moieties CrystEngComm, 2010, 12, 1217 |
| 7212228 | CIF | C14 H18 N2 O4 | P b c n | 17.216; 6.674; 23.473 90; 90; 90 | 2697 | Marivel, Samipillai; Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I. Mechanochemical preparation of adducts (co-crystals and molecular salts) of 1,4-diazabicyclo-[2.2.2]-octane with aromatic polycarboxylic acids CrystEngComm, 2010, 12, 2107 |
| 7212264 | CIF | C18 H14 N4 O5 | P b c n | 9.991; 22.751; 7.1579 90; 90; 90 | 1627 | Hou, Gui-Ge; Ma, Jian-Ping; Wang, Le; Wang, Ping; Dong, Yu-Bin; Huang, Ru-Qi Co-crystallization of oxadiazole-bridged pyridyl-N-oxide building modules with R-aromatics (R = –OH, –NH2 and –COOH) CrystEngComm, 2010, 12, 4287 |
| 7212272 | CIF | C12 H8 N4 O3 | P b c n | 5.542; 12.465; 16.069 90; 90; 90 | 1110.1 | Hou, Gui-Ge; Ma, Jian-Ping; Wang, Le; Wang, Ping; Dong, Yu-Bin; Huang, Ru-Qi Co-crystallization of oxadiazole-bridged pyridyl-N-oxide building modules with R-aromatics (R = –OH, –NH2 and –COOH) CrystEngComm, 2010, 12, 4287 |
| 7212803 | CIF | C26 H21 Cu N4 O5.5 S | P b c n | 18.175; 8.735; 30.413 90; 90; 90 | 4828.3 | Hu, Sheng; Zhang, Ze-Ming; Meng, Zhao-Sha; Lin, Zhuo-Jia; Tong, Ming-Liang Anion-dependent construction of copper(i/ii)-1,2,4,5-tetra(4-pyridyl)benzene frameworks CrystEngComm, 2010, 12, 4378 |
| 7213126 | CIF | C20 H27 N O5 | P b c n | 24.3829; 9.896; 15.7266 90; 90; 90 | 3794.7 | Thuéry, Pierre; Nierlich, Martine; Baldwin, Bruce W.; Aoki, Yoshio; Hirose, Takuji Conformation of cis,trans-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid derivatives: crystal structures and semiempirical molecular orbital calculations Journal of the Chemical Society, Perkin Transactions 2, 1999, 2077 |
| 7213269 | CIF | C23 H19 N2 O3.5 | P b c n | 25.868; 7.826; 18.105 90; 90; 90 | 3665.2 | Kumar, Subodh; Hundal, Geeta; Paul, Dharam; Hundal, Maninder Singh; Singh, Harjit Heterocalixarenes. Part 4. Synthesis of oxocalix[1]heterocycle[2]arenes: a unique H-bonding network in calix[1]benzimidazol-2-one[2]arene· 1/2 H2O † Journal of the Chemical Society, Perkin Transactions 1, 2000, 2295 |
| 7213366 | CIF | C74 H94 Cl12 O6 | P b c n | 37.11; 10.064; 20.82 90; 90; 90 | 7776 | Sawada, Tsuyoshi; Yamada, Masaki; Thiemann, Thies; Mataka, Shuntaro Preparation and structures of novel [2.2.2]metacyclophane tweezers Journal of the Chemical Society, Perkin Transactions 1, 2000, 2623 |
| 7213490 | CIF | C11 H21 B F4 N2 | P b c n | 18.086; 9.7339; 7.6426 90; 90; 90 | 1345.46 | Alder, Roger W.; Blake, Michael E.; Bufali, Simone; Butts, Craig P.; Orpen, A. Guy; Schütz, Jan; Williams, Stuart J. Preparation of tetraalkylformamidinium salts and related species as precursors to stable carbenes Journal of the Chemical Society, Perkin Transactions 1, 2001, 1586 |
| 7213867 | CIF | C88 H100 Cd3 Cl2 N8 O34 | P b c n | 18.433; 17.712; 30.096 90; 90; 90 | 9826 | Ren, Cai-Xia; Zheng, Ai-Li; Cai, Li-Xuan; Chen, Cheng; Tan, Bin; Zhang, Jie Anion-induced structural transformation involving interpenetration control and luminescence switching CrystEngComm, 2014, 16, 1038 |
| 7213910 | CIF | C26 H24 Cu3 N4 O12 | P b c n | 18.0747; 11.8777; 12.5442 90; 90; 90 | 2693.1 | Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands CrystEngComm, 2014, 16, 870 |
| 7213915 | CIF | C27 H24 Mn N4 O5 | P b c n | 16.564; 18.302; 15.879 90; 90; 90 | 4813.8 | Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands CrystEngComm, 2014, 16, 870 |
| 7214062 | CIF | C20 H16 Cd N6 O6 | P b c n | 19.6725; 10.3235; 10.5318 90; 90; 90 | 2138.9 | Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties CrystEngComm, 2014, 16, 1632 |
| 7214066 | CIF | C17 H17 F3 N2 S | P b c n | 9.359; 19.512; 18.547 90; 90; 90 | 3386.9 | Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M. Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines CrystEngComm, 2014, 16, 1755 |
| 7214161 | CIF | C18 H15 N8 O6.5 S Zn2 | P b c n | 30.671; 16.577; 9.851 90; 90; 90 | 5008.6 | Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers CrystEngComm, 2014, 16, 2615 |
| 7214240 | CIF | C53 H40 Co3 N4 O12 | P b c n | 13.9345; 26.096; 19.2265 90; 90; 90 | 6991.4 | Shi, Jing-Tao; Yue, Ke-Fen; Liu, Bo; Zhou, Chun-sheng; Liu, Yong-Liang; Fang, Zhi-Guo; Wang, Yao-Yu Two porous metal‒organic frameworks (MOFs) based on mixed ligands: synthesis, structure and selective gas adsorption CrystEngComm, 2014, 16, 3097 |
| 7214308 | CIF | C10 H19 N2 O5 | P b c n | 12.1669; 12.065; 19.2806 90; 90; 90 | 2830.3 | Wang, Yan-Bo; Sun, Dong-Sheng; Zhou, Hui; Zhang, Wen-Zhen; Lu, Xiao-Bing Alkoxide-functionalized imidazolium betaines for CO2 activation and catalytic transformation Green Chemistry, 2014, 16, 2266 |
| 7214420 | CIF | C3 H9 N | P b c n | 23.287; 6.2354; 5.9794 90; 90; 90 | 868.23 | Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines CrystEngComm, 2014, 16, 3867 |
| 7214421 | CIF | C4 H11 N | P b c n | 26.7852; 6.8166; 5.6703 90; 90; 90 | 1035.31 | Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines CrystEngComm, 2014, 16, 3867 |
| 7214422 | CIF | C5 H13 N | P b c n | 33.546; 6.4878; 5.7295 90; 90; 90 | 1247 | Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines CrystEngComm, 2014, 16, 3867 |
| 7214460 | CIF | C7 H5 Eu0.44 N O5 Y0.56 | P b c n | 7.4519; 19.2623; 12.3897 90; 90; 90 | 1778.4 | Zhang, Yu; Ju, Weiwei; Xu, Xiao; Lv, Yun; Zhu, Dunru; Xu, Yan Two novel mixed Eu3+/Y3+ Ln MOFs: influence of pH on the topology, Eu/Y ratio and energy transfer CrystEngComm, 2014, 16, 5681 |
| 7214511 | CIF | C34 H44 Cl7 I2 N O2 | P b c n | 8.557; 14.816; 31.189 90; 90; 90 | 3954.2 | Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo Polymorphs and co-crystals of haloprogin: an antifungal agent CrystEngComm, 2014, 16, 5897 |
| 7214512 | CIF | C34 H44 Cl6 I3 N O2 | P b c n | 8.9174; 15.2187; 31.429 90; 90; 90 | 4265.3 | Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo Polymorphs and co-crystals of haloprogin: an antifungal agent CrystEngComm, 2014, 16, 5897 |
| 7214672 | CIF | C13 H16 Br2 Cu2 Gd N2 O10 | P b c n | 9.9176; 32.983; 12.9111 90; 90; 90 | 4223.4 | Peng, Guo; Liu, Zhihui; Ma, Li; Liang, Li; Zhang, Limin; Kostakis, George. E; Deng, Hong A series of 3d‒4f heterometallic coordination polymers constructed from size-tunable copper halide clusters and lanthanide-organic motifs CrystEngComm, 2012, 14, 5974 |
| 7214673 | CIF | C13 H16 Br2 Cu2 Er N2 O10 | P b c n | 9.8237; 32.797; 12.751 90; 90; 90 | 4108.2 | Peng, Guo; Liu, Zhihui; Ma, Li; Liang, Li; Zhang, Limin; Kostakis, George. E; Deng, Hong A series of 3d‒4f heterometallic coordination polymers constructed from size-tunable copper halide clusters and lanthanide-organic motifs CrystEngComm, 2012, 14, 5974 |
| 7214690 | CIF | C23 H18 F6 O4 | P b c n | 11.1508; 7.3171; 24.5176 90; 90; 90 | 2000.4 | Iwase, Noriaki; Kobayashi, Yuhei; Kinuta, Takafumi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Matsubara, Yoshio; Imai, Yoshitane Solid-state visible molecular recognition system of bisphenol A and its derivatives by solid co-grinding crystallization with benzoquinone CrystEngComm, 2012, 14, 8599 |
| 7214691 | CIF | C22 H15 Cl F6 O4 | P b c n | 11.2984; 7.2275; 24.573 90; 90; 90 | 2006.6 | Iwase, Noriaki; Kobayashi, Yuhei; Kinuta, Takafumi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Matsubara, Yoshio; Imai, Yoshitane Solid-state visible molecular recognition system of bisphenol A and its derivatives by solid co-grinding crystallization with benzoquinone CrystEngComm, 2012, 14, 8599 |
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