Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7224959 | CIF | O10 Rb2 W3 | I -4 | 15.9516; 15.9516; 10.0565 90; 90; 90 | 2558.9 | Zhang, Min; Lian, Zhipeng; Wang, Ying; Pan, Shilie Nonlinear optical and self-activated luminescent properties of A2W3O10(A = Rb and Cs) RSC Adv., 2016, 6, 39234 |
| 7226255 | CIF | Ga2.4 K2.4 Se8 Si1.6 | I 4/m c m | 8.1999; 8.1999; 6.146 90; 90; 90 | 413.25 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226257 | CIF | Ga2.4 K2.4 S8 Si1.6 | I 4/m c m | 7.891; 7.891; 5.866 90; 90; 90 | 365.26 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226254 | CIF | Ga2.4 Ge1.6 K2.4 Se8 | I 4/m c m | 8.1208; 8.1208; 6.208 90; 90; 90 | 409.4 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226256 | CIF | Ga2.4 Ge1.6 K2.4 S8 | I 4/m c m | 7.8824; 7.8824; 5.9557 90; 90; 90 | 370.04 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7224958 | CIF | Cs2 O10 W3 | I -4 | 16.098; 16.098; 10.1703 90; 90; 90 | 2635.6 | Zhang, Min; Lian, Zhipeng; Wang, Ying; Pan, Shilie Nonlinear optical and self-activated luminescent properties of A2W3O10(A = Rb and Cs) RSC Adv., 2016, 6, 39234 |
| 7224691 | CIF HKL | Ca8.98 Dy0.11 F2 La0.92 O24 P5 Si | P 63/m | 9.42716; 9.42716; 6.92158 90; 90; 120 | 532.718 | Haikun Liu; Libing Liao; Maxim S. Molokeev; Qingfeng Guo; Yuanyuan Zhang; Lefu Mei A novel single-phase white light emitting phosphor Ca9La(PO4)5(SiO4)F2:Dy3+: synthesis, crystal structure and luminescence properties RSC Advances, 2016, 6, 24577-24583 |
| 7224690 | CIF HKL | Ca8.88 F2 La1.12 O24 P5 Si | P 63/m | 9.43197; 9.43197; 6.92605 90; 90; 120 | 533.606 | Haikun Liu; Libing Liao; Maxim S. Molokeev; Qingfeng Guo; Yuanyuan Zhang; Lefu Mei A novel single-phase white light emitting phosphor Ca9La(PO4)5(SiO4)F2:Dy3+: synthesis, crystal structure and luminescence properties RSC Advances, 2016, 6, 24577-24583 |
| 7226814 | CIF | C98 H132 Cd2 Fe2 N10 Na O38 | P 1 21/c 1 | 24.576; 12.416; 18.094 90; 102.534; 90 | 5389.5 | Ma, Li; Du, Peng; Yang, Jin; Liu, Ying-Ying; Liu, Xiao-Li; Ma, Jian-Fang Two heterotrimetallic organic frameworks constructed using a functionalized Schiff base ligand: syntheses, structures and visible photocatalytic activities for the degradation of chlorophenols RSC Adv., 2016, 6, 98611 |
| 7224375 | CIF | C95.6 H119 Cu4 Na4 O29.8 Si12 | C 1 2/c 1 | 24.6412; 19.7915; 27.463 90; 113.73; 90 | 12261 | Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M. Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom RSC Adv., 2016, 6, 22052 |
| 7236247 | CIF | C92 H70 N4 O4 P4 Ru | P -1 | 12.3881; 13.1663; 13.5475 81.201; 64.451; 81.228 | 1960.84 | Shen, Chang; Yu, Fei; Chu, Wing-Kin; Xiang, Jing; Tan, Peng; Luo, Ya; Feng, Hua; Guo, Zheng-Qing; Leung, Chi-Fai; Lau, Tai-Chu Synthesis, structures and photophysical properties of luminescent cyanoruthenate(ii) complexes with hydroxylated bipyridine and phenanthroline ligands RSC Advances, 2016, 6, 87389 |
| 7226668 | CIF | C9 H16 N O2 | P c a 21 | 7.8102; 11.8025; 10.2102 90; 90; 90 | 941.18 | Nelyubina, Yu. V.; Ananyev, I. V.; Novikov, V. V.; Lyssenko, K. A. Invariom approach to electron density studies of open-shell compounds: the case of an organic nitroxide radical RSC Adv., 2016, 6, 91694 |
| 7223536 | CIF | C84 H89.5 Fe2 N20 O8.75 | A e a 2 | 14.6547; 34.5808; 35.0669 90; 90; 90 | 17770.9 | Papadakis, Raffaello; Deligkiozi, Ioanna; Giorgi, Michel; Faure, Bruno; Tsolomitis, Athanase Supramolecular complexes involving non-symmetric viologen cations and hexacyanoferrate(II) anions. A spectroscopic, crystallographic and computational study. RSC Advances, 2015, 6, 575-585 |
| 7226520 | CIF | C83 H110 O20 | P 21 21 21 | 6.27813; 10.3446; 27.8319 90; 90; 90 | 1807.54 | Song, Jia-Ling; Yuan, Yao; Tan, Hai-Bo; Wu, Jie-Wei; Huang, Ri-Ming; Li, Heng; Xu, Zhi-Fang; Na, Ning; Qiu, Sheng-Xiang Euryachins A and B, a new type of diterpenoids from Eurya chinensis with potent NO production inhibitory activity RSC Adv., 2016, 6, 85958 |
| 7224186 | CIF | C8 H32 Ge2 N8 O S6 V2 | P 1 21/n 1 | 8.3522; 12.682; 11.339 90; 94.75; 90 | 1196.9 | Qian, Li-Wen; Zhao, Xiao-Wei; Su, Hu-Chao; Bian, Guo-Qing; Zhu, Qin-Yu; Dai, Jie Supramolecular hexagonal nano tubes assembled by vanadium diamine complexes with thiogermanates RSC Adv., 2016, 6, 16268 |
| 7236027 | CIF | C8 H28 Al12 Mg4 N4 O73 P16 | P 1 21/c 1 | 12.675; 14.423; 9.5745 90; 100.568; 90 | 1720.6 | Jiao, Xuejiao; Wang, Yanyan; Mu, Ying; Sun, Yanjun; Li, Jiyang A new magnesium-containing aluminophosphate with a zeolite-like structure RSC Advances, 2016, 6, 1098 |
| 7236266 | CIF | C72 H99 Cr3 Cu4 Mo18 N16 O76 | P -1 | 14.4947; 15.7549; 15.8183 99.314; 116.519; 91.546 | 3169.4 | Gong, Chunhua; Zeng, Xianghua; Zhu, Chengfeng; Shu, Jiahui; Xiao, Pingxiu; Xu, Hao; Liu, Lichun; Zhang, Junyong; Zeng, Qingdao; Xie, Jingli A series of organic‒inorganic hybrid materials consisting of flexible organic amine modified polyoxomolybdates: synthesis, structures and properties RSC Advances, 2016, 6, 106248 |
| 7236249 | CIF | C72 H40 K3 O67 | P 1 21 1 | 13.813; 33.186; 13.971 90; 118.69; 90 | 5618.03 | Sha, Jing-Quan; Zhong, Xiao-Hua; Wu, Lian-He; Liu, Guo-Dong; Sheng, Ning Nontoxic and renewable metal‒organic framework based on α-cyclodextrin with efficient drug delivery RSC Advances, 2016, 6, 82977 |
| 7225889 | CIF | C7 H9 Cl N2 O4 | P 1 | 5.0265; 6.184; 8.1859 93.095; 102.264; 106.883 | 236.1 | Spaniol, Jacqueline M.; Wheeler, Kraig A. Accessing Centnerszwer's quasiracemate ‒ molecular shape controlled molecular recognition RSC Adv., 2016, 6, 64921 |
| 7225887 | CIF | C7 H9 Br N2 O4 | P -1 | 8.0994; 8.3605; 8.8967 101.264; 106.468; 118.411 | 467.59 | Spaniol, Jacqueline M.; Wheeler, Kraig A. Accessing Centnerszwer's quasiracemate ‒ molecular shape controlled molecular recognition RSC Adv., 2016, 6, 64921 |
| 7225888 | CIF | C7 H9 Br N2 O4 | P 1 21 1 | 7.2825; 8.8079; 8.0544 90; 108.936; 90 | 488.68 | Spaniol, Jacqueline M.; Wheeler, Kraig A. Accessing Centnerszwer's quasiracemate ‒ molecular shape controlled molecular recognition RSC Adv., 2016, 6, 64921 |
| 7226402 | CIF | C7 H5 N O3 S | P 1 21/c 1 | 9.444; 6.921; 11.684 90; 103.05; 90 | 743.965 | Du, Jonathan J.; Váradi, Linda; Williams, Peter A.; Groundwater, Paul W.; Overgaard, Jacob; Platts, James A.; Hibbs, David E. An analysis of the experimental and theoretical charge density distributions of the piroxicam‒saccharin co-crystal and its constituents RSC Adv., 2016, 6, 81578 |
| 7226482 | CIF | C7 H5 N O2 | P 21 21 21 | 4.4436; 6.641; 20.957 90; 90; 90 | 618.4 | Singh, Anoop S.; Kumar, Dhananjay; Mishra, Nidhi; Tiwari, Vinod K. An efficient one-pot synthesis of N,N′-disubstituted ureas and carbamates from N-acylbenzotriazoles RSC Adv., 2016, 6, 84512 |
| 7226195 | CIF | C7 H5 Br N4 O2 | P b c a | 7.169; 13.975; 18.344 90; 90; 90 | 1837.8 | Kumar, Arvind; Kumar, Satyanand; Khajuria, Yugal; Awasthi, Satish Kumar A comparative study between heterogeneous stannous chloride loaded silica nanoparticles and a homogeneous stannous chloride catalyst in the synthesis of 5-substituted 1H-tetrazole RSC Adv., 2016, 6, 75227 |
| 7226793 | CIF | C68 H57 B Fe N2 P2 | P -1 | 12.8422; 13.4375; 17.1011 84.713; 87.183; 64.505 | 2652.2 | Albertin, Gabriele; Antoniutti, Stefano; Bortoluzzi, Marco; Botter, Alessandra; Castro, Jesús; Sibilla, Francesca Preparation of diazoalkane complexes of iron(ii) RSC Adv., 2016, 6, 97650 |
| 7224159 | CIF | C68 H47 N7 O Zn | P 1 21/c 1 | 13.1741; 20.85; 19.578 90; 102.558; 90 | 5249 | Lanzilotto, Angelo; Büldt, Laura A.; Schmidt, Hauke C.; Prescimone, Alessandro; Wenger, Oliver S.; Constable, Edwin C.; Housecroft, Catherine E. Improved light absorbance does not lead to better DSC performance: studies on a ruthenium porphyrin‒terpyridine conjugate RSC Adv., 2016, 6, 15370 |
| 7236243 | CIF | C62 H64 Ca N4 P2 S2 | C 1 2/c 1 | 22.6518; 10.3398; 25.6988 90; 115.912; 90 | 5413.9 | Anga, Srinivas; Carpentier, Jean-François; Panda, Tarun K.; Roisnel, Thierry; Sarazin, Yann Calcium complexes with imino-phosphinanilido chalcogenide ligands for heterofunctionalisation catalysis RSC Advances, 2016, 6, 57835 |
| 7224374 | CIF | C60 H96 O12 Si12 | P -1 | 12.919; 13.675; 23.8149 76.271; 77.6651; 74.0613 | 3880 | Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M. Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom RSC Adv., 2016, 6, 22052 |
| 7236214 | CIF | C6.5 H6.5 N6.5 O6.5 | P -1 | 10.6863; 11.6232; 11.9288 76.255; 64.109; 88.571 | 1289.5 | Hu, Xiao-Hui; Pu, Xiao-Qiu; Liu, Rui; Cui, Chun-Xiao; Yang, Jun; Yang, Xian-Jin A facile access to cis-dihydrofurobenzofuran from 2-(2,5-dihydro-furan-2-yl)-phenol RSC Advances, 2016, 6, 58613 |
| 7226179 | CIF | C6 H8 O3 S | P 21 21 21 | 7.1126; 8.151; 25.807 90; 90; 90 | 1496.16 | Mangalum, A.; Boadi, F.; Masand, S. A.; Lalancette, R. A.; Pietrangelo, A. A Pb2±binding polychelatogen derived from thionated lactide RSC Adv., 2016, 6, 74250 |
| 7226181 | CIF | C6 H8 O2 S2 | P c a 21 | 12.8947; 8.5141; 7.3227 90; 90; 90 | 803.936 | Mangalum, A.; Boadi, F.; Masand, S. A.; Lalancette, R. A.; Pietrangelo, A. A Pb2±binding polychelatogen derived from thionated lactide RSC Adv., 2016, 6, 74250 |
| 7226624 | CIF | C6 H2 N10 O10 | P 1 21/n 1 | 7.3983; 7.6242; 11.7823 90; 94.006; 90 | 662.97 | Tang, Yongxing; Gao, Haixiang; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Energetic dinitromethyl group functionalized azofurazan and its azofurazanates RSC Adv., 2016, 6, 91477 |
| 7224673 | CIF | C6 H12 Bi Br N2 S4 | P 1 21/c 1 | 10.218; 16.3552; 8.2644 90; 100.927; 90 | 1356.08 | Arda, M.; Ozturk, I. I.; Banti, C. N.; Kourkoumelis, N.; Manoli, M.; Tasiopoulos, A. J.; Hadjikakou, S. K. Novel bismuth compounds: synthesis, characterization and biological activity against human adenocarcinoma cells RSC Adv., 2016, 6, 29026 |
| 7224675 | CIF | C6 H12 Bi Br N2 S4 | P 1 21/c 1 | 10.2109; 16.3665; 8.2545 90; 101.026; 90 | 1354 | Arda, M.; Ozturk, I. I.; Banti, C. N.; Kourkoumelis, N.; Manoli, M.; Tasiopoulos, A. J.; Hadjikakou, S. K. Novel bismuth compounds: synthesis, characterization and biological activity against human adenocarcinoma cells RSC Adv., 2016, 6, 29026 |
| 7226625 | CIF | C6 F2 N10 O10 | P 1 21/n 1 | 7.2868; 7.7602; 12.5498 90; 90.952; 90 | 709.56 | Tang, Yongxing; Gao, Haixiang; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Energetic dinitromethyl group functionalized azofurazan and its azofurazanates RSC Adv., 2016, 6, 91477 |
| 7226019 | CIF | C56 H48 N2 O2 | P 1 21/c 1 | 10.9788; 25.286; 16.0994 90; 100.188; 90 | 4398.9 | Irgashev, Roman A.; Kazin, Nikita A.; Kim, Grigory A.; Rusinov, Gennady L.; Charushin, Valery N. A new synthetic approach to fused nine-ring systems of the indolo[3,2-b]carbazole family through double Pd-catalyzed intramolecular C‒H arylation RSC Adv., 2016, 6, 70106 |
| 7224549 | CIF | C56 H30 Eu2 N4 O16 | P -1 | 11.6136; 13.4816; 16.281 89.934; 78.409; 71.845 | 2367.6 | Liu, Jingjuan; Sun, Wei; Liu, Zhiliang White-light emitting materials with tunable luminescence based on steady Eu(iii) doping of Tb(iii) metal‒organic frameworks RSC Adv., 2016, 6, 25689 |
| 7224299 | CIF | C54 H82 B Ge N5 | P -1 | 12.41; 15.971; 26.276 101.799; 95.207; 98.138 | 5007.9 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7226787 | CIF | C54 H45 As2 Cl3 N2 O3 Ru | P 1 21/n 1 | 15.5853; 18.629; 17.3913 90; 95.754; 90 | 5023.9 | Manikandan, Thimma Sambamoorthy; Ramesh, Rengan; Semeril, David Synthesis and characterisation of cycloruthenated benzhydrazone complexes: catalytic application to selective oxidative cleavage of olefins to aldehydes RSC Adv., 2016, 6, 97107 |
| 7236205 | CIF | C53 H67 F6 Fe N4 O10 P | P -1 | 10.0198; 14.171; 21.521 70.946; 78.528; 70.905 | 2714.9 | Yu, Gilbert; Suzaki, Yuji; Osakada, Kohtaro Ferrocene-containing [1]-, [2]-, [3]- and [4]rotaxanes synthesized from a common precursor RSC Advances, 2016, 6, 41369 |
| 7226796 | CIF | C53 H57 N S8 | P -1 | 4.6484; 13.9788; 19.2908 105.132; 90.17; 98.42 | 1195.88 | Magnan, François; Gabidullin, Bulat; Brusso, Jaclyn L. Applying thieno[3,2-b]thiophene as a building block in the design of rigid extended thienoacenes RSC Adv., 2016, 6, 97420 |
| 7226786 | CIF | C53 H42 As2 Br Cl3 N2 O2 Ru | P 1 21/n 1 | 15.2764; 18.6423; 17.4632 90; 95.039; 90 | 4954.1 | Manikandan, Thimma Sambamoorthy; Ramesh, Rengan; Semeril, David Synthesis and characterisation of cycloruthenated benzhydrazone complexes: catalytic application to selective oxidative cleavage of olefins to aldehydes RSC Adv., 2016, 6, 97107 |
| 7236227 | CIF | C52 H60 Ag2 N10 O6 | P 1 21/n 1 | 11.555; 10.932; 20.204 90; 92.21; 90 | 2550.3 | Zhang, Han; Xu, Yuling; Wu, Huilu; Aderinto, Stephen Opeyemi; Fan, Xuyang Mono-, bi- and multi-nuclear silver complexes constructed from bis(benzimidazole)-2-oxapropane ligands and methacrylate: syntheses, crystal structures, DNA-binding properties and antioxidant activities RSC Advances, 2016, 6, 83697 |
| 7226545 | CIF | C50 H56 N2 Si2 | P -1 | 8.7368; 14.7568; 17.2163 83.552; 77.427; 76.645 | 2103.3 | Hoff, John J.; Zhu, Lei; Dong, Yutong; Albers, Thomas; Steel, Peter J.; Cui, Xianwei; Wen, Ying; Lebedyeva, Iryna; Miao, Shaobin Diazapentacene derivatives: synthesis, properties, and structures RSC Adv., 2016, 6, 86824 |
| 7226579 | CIF | C50 H54 Ag2 N2 P2 S4 | P -1 | 10.538; 10.8294; 11.2159 78.167; 84.072; 77.604 | 1221.2 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7224672 | CIF | C5 H10 Bi Br2 N S2 | P 1 21/c 1 | 10.0768; 14.766; 7.846 90; 91.716; 90 | 1166.91 | Arda, M.; Ozturk, I. I.; Banti, C. N.; Kourkoumelis, N.; Manoli, M.; Tasiopoulos, A. J.; Hadjikakou, S. K. Novel bismuth compounds: synthesis, characterization and biological activity against human adenocarcinoma cells RSC Adv., 2016, 6, 29026 |
| 7236208 | CIF | C49 H0 La2 N11 O17 | C 1 2/c 1 | 32.118; 15.2133; 13.1789 90; 95.256; 90 | 6412.4 | Wang, Di; Sun, Libo; Hao, Chuanqing; Yan, Yan; Liang, Zhiqiang Lanthanide metal‒organic frameworks based on a 1,2,3-triazole-containing tricarboxylic acid ligand for luminescence sensing of metal ions and nitroaromatic compounds RSC Advances, 2016, 6, 57828 |
| 7224381 | CIF | C48 H68 Cl4 N8 O6 Zr2 | P -1 | 9.9338; 11.1209; 14.56 106.403; 91.013; 108.188 | 1456 | Mandal, Dipa; Chakraborty, Debashis; Ramkumar, Venkatachalam; Chand, Dillip Kumar Group 4 alkoxide complexes containing [NNO]-type scaffold: synthesis, structural characterization and polymerization studies RSC Adv., 2016, 6, 21706 |
| 7226815 | CIF | C48 H58 Fe N4 Na O17 Zn | P 1 21/c 1 | 24.05; 12.458; 18.14 90; 104.466; 90 | 5263 | Ma, Li; Du, Peng; Yang, Jin; Liu, Ying-Ying; Liu, Xiao-Li; Ma, Jian-Fang Two heterotrimetallic organic frameworks constructed using a functionalized Schiff base ligand: syntheses, structures and visible photocatalytic activities for the degradation of chlorophenols RSC Adv., 2016, 6, 98611 |
| 1544179 | CIF | C48 H36 N7 O8 S2 | P -1 | 6.817; 18.957; 20.898 103.091; 90.526; 94.227 | 2622 | Shweta, Shweta; Kumar, Ajit; Neeraj, Neeraj; Asthana, Sharad Kumar; Prakash, Anand; Roy, Jagat Kumar; Tiwari, Ida; Upadhyay, K. K. A highly sensitive naphthaoxazole-based cell-permeable ratiometric chemodosimeter for hydrazine RSC Advances, 2016, 6, 94959-94966 |
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