Crystallography Open Database
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Result: there are 96 entries in the selection
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Searching journal of publication like 'Journal of Molecular Structure'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1532645 | CIF | As6 H24 O53 V15 Zn2 | R 3 :H | 12.0601; 12.0601; 33.97 90; 90; 120 | 4278.86 | Cui Xiaobing; Xu Jiqing; Ding Lan; Ding Hong; Yang Guoyu; Ye Ling Hydrothermal synthesis, crystal structure and characterization of (Zn (H2 O)4)2 (H2 As6 V15 O42 (H2 O)) * 2(H2 O) Journal of Molecular Structure, 2003, 660, 131-137 |
| 1532658 | CIF | Co0.9996 K4 Mo3.9996 O57 Si W6.9996 | P 4/m n c | 14.096; 14.096; 12.373 90; 90; 90 | 2458.48 | Dai Liyi; Shan Yongkui; He Mingyuan Synthesis and structure of tetrabasic tungstomolybdosilicate complex with cobalt: K4 H2 (Si W7 Mo4 Co (H2 O) O39) * 22(H2 O) Journal of Molecular Structure, 2003, 644, 165-170 |
| 1532894 | CIF | F11 H6 K5 Mo3 O2 S4 | C m c 21 | 15.106; 8.782; 14.3358 90; 90; 90 | 1901.8 | Mironov, Yu.V.; Yarovoi, S.S.; Solodovnikov, S.F.; Fedorov, V.E. Coordinated bifluoride ions in the first thiofluoride molybdenum triangular cluster complex: synthesis and crystal structure of K5 (Mo3 S4 F7 (F H F)2) * 2(H2 O) Journal of Molecular Structure, 2003, 656, 195-199 |
| 1533326 | CIF | B8 Ca H24 O26 Rb2 | P 21 21 21 | 11.536; 12.639; 16.69 90; 90; 90 | 2433.46 | Zhu Lixia; Yue Tao; Gao Shiyang; Hu Mancheng; Yu Kaibei Crystal structure and characterization of Rb2 Ca (B4 O5 (O H)4)2 * 8(H2 O) Journal of Molecular Structure, 2003, 658, 215-222 |
| 1534429 | CIF | Na4 O183 P4 W32 Zr4 | P -1 | 12.89; 14.01; 27.138 79.881; 79.571; 65.93 | 4372.35 | Gaunt, A. J.; May, I.; Collison, D.; Pope, M. T.; Holman, K. T. Polyoxometal cations within polyoxometalate anions. Seven-coordinate uranium and zirconium heteroatom groups in ((U O~2~)~12~(μ~3~-O)4(μ~2~-H~2~ O)~12~(P~2~ W~15~ O~56~)~4~)^32-^ and (Zr~4~(μ~3~-O)~2~(μ~2~-O H)~2~(H~2~ O)~4~(P~2~ W~16~ O~59~)~2~)^14-^ Journal of Molecular Structure, 2003, 656, 101-106 |
| 1534432 | CIF | O341 P8 U12 W60 | C 1 2/c 1 | 40.355; 43.385; 28.573 90; 134.622; 90 | 35606.1 | Gaunt, A. J.; May, I.; Collison, D.; Holman, K. T.; Pope, M. T. Polyoxometal cations within polyoxometalate anions. Seven-coordinate uranium and zirconium heteroatom groups in ((U O~2~)~12~(μ~3~-O)4(μ~2~-H~2~ O)~12~(P~2~ W~15~ O~56~)~4~)^32-^ and (Zr~4~(μ~3~-O)~2~(μ~2~-O H)~2~(H~2~ O)~4~(P~2~ W~16~ O~59~)~2~)^14-^ Journal of Molecular Structure, 2003, 656, 101-106 |
| 1534810 | CIF | H7 Na5 O18 Se4 | P -1 | 5.959; 7.268; 9.958 102.5; 98.71; 100.36 | 405.976 | Baran, J.; Lis, T.; Starynowicz, P. Structure and vibrational spectra of Na5 H3 (Se O4)4 * 2(H2 O) crystal Journal of Molecular Structure, 1989, 213, 51-61 |
| 1535964 | CIF | Cl5 Cr Cs2 H8 O4 | C 1 2/c 1 | 19.153; 6.141; 13.92 90; 118.24; 90 | 1442.37 | Neumann, E.; Engelen, B.; Stefov, V.; Soptrajanov, B.; Lutz, H.D. Crystal structure and infrared spectra of dicesium trans-tetraaquadichlorochromium(III) chloride Journal of Molecular Structure, 2004, 708, 105-111 |
| 1536001 | CIF | Br2 Cu2 P8 Se3 | P b c m | 8.761; 11.957; 13.858 90; 90; 90 | 1451.7 | Nilges, S.; Nilges, T.; Pfitzner, A.; Haeuseler, H. (Cu Br)2 P8 Se3: preparation, structural, and vibrational sprectroscopic characterization of an adduct of P8 Se3 cages to Cu2 Br2 rhombs Journal of Molecular Structure, 2004, 706, 89-94 |
| 1536064 | CIF | Er4 K2 O117 Si2 W22 | P -1 | 12.463; 14.849; 16.772 95.37; 94.65; 106.76 | 2939.92 | Niu, J.; Zhao, J.; Wang, J. Synthesis, characterization and crystal structure of a ErIII mono-substituted [-Si W11 O39]8- polyoxotungstate containing one-dimensional zigzag chainlike structure Journal of Molecular Structure, 2004, 701, 19-24 |
| 1536738 | CIF | Fe2 H8 O10 Se2 | P 1 21/n 1 | 6.5283; 8.8754; 7.6798 90; 98.82; 90 | 439.716 | Xiao, D.; An, H.; Wang, E.; Xu, L. Synthesis and structure of a novel three-dimensional metal selenite containing multidirectional intersecting double helical chains: [Fe2 (H2 O)4 (Se O3)2] Journal of Molecular Structure, 2005, 740, 249-253 |
| 1536892 | CIF | H16 Mo10 Na4 O40 | R 3 2 :H | 15.681; 15.681; 12.398 90; 90; 120 | 2640.16 | Feng, L.-Y.; Xu, Y.; Wang, Y.-H.; Hu, C.-W.; Qi, Y.-J.; Wang, E.-B. Synthesis and crystal structure of the first Waugh-type isopolyoxomolybdate Na4 Mo10 O32 * 8(H2 O) Journal of Molecular Structure, 2003, 645, 231-234 |
| 1541212 | CIF | Cs3 La N18 | P -1 | 9.445; 9.848; 10.105 98.58; 110.13; 102.12 | 837.343 | Mautner, F.A.; Fritzer, H.P.; Krischner, H.; Kratky, C. The crystals structure of a many-fold connected complex of lanthanum in Cs3La(N3)6 Journal of Molecular Structure, 1989, 213, 169-174 |
| 1544272 | CIF HKL | C11 H20 Co N11 O3 S | P -1 | 7.3164; 11.4668; 11.9873 110.369; 100.918; 97.158 | 905.69 | Rajni Sharma; Raj Pal Sharma; Konstantin Karaghiosoff; Thomas M. Klapoetke; Miguel Quirós; Juan M. Salas Cationic Cobaltammines as Anion Receptors: Synthesis, Spectroscopic and X-ray Structural Study of Biologically Important Saccharinate Salt, [cis-Co(en)~2~(N~3~)~2~](C~7~H~4~NSO~3~) Journal of Molecular Structure, 2009, 930, 88-94 |
| 1545239 | CIF | H16 La2 O20 S3 | P 1 n 1 | 6.881; 17.376; 6.923 90; 92.34; 90 | 827.1 | Vanderpool, Richard A.; Khan, Masood A.; Frech, Roger Structure and Raman spectra of single-crystal La2(SO4)3.8H2O Journal of Molecular Structure, 1991, 245, 255-273 |
| 1547307 | CIF | C21 H25 F N5 O7.28 | P -1 | 10.3252; 13.8631; 16.9586 101.243; 92.514; 109.471 | 2229.09 | N.N. Golovnev; M.S. Molokeev; M.K. Lesnikov; I.V. Sterkhova; V.V. Atuchin Thiobarbiturate and barbiturate salts of pefloxacin drug: Growth, structure, thermal stability and IR-spectra Journal of Molecular Structure, 2017, 1149, 367-372 |
| 1547308 | CIF | C21 H24 F N5 O5 S | P 1 21/c 1 | 12.0768; 14.712; 12.2222 90; 95.109; 90 | 2162.9 | N.N. Golovnev; M.S. Molokeev; M.K. Lesnikov; I.V. Sterkhova; V.V. Atuchin Thiobarbiturate and barbiturate salts of pefloxacin drug: Growth, structure, thermal stability and IR-spectra Journal of Molecular Structure, 2017, 1149, 367-372 |
| 1547309 | CIF | C21 H30 F N5 O8 S | P -1 | 8.4651; 9.3753; 15.8077 89.484; 88.735; 78.147 | 1227.48 | N.N. Golovnev; M.S. Molokeev; M.K. Lesnikov; I.V. Sterkhova; V.V. Atuchin Thiobarbiturate and barbiturate salts of pefloxacin drug: Growth, structure, thermal stability and IR-spectra Journal of Molecular Structure, 2017, 1149, 367-372 |
| 1549448 | CIF | C7 H6 N4 O2 | P 1 21/c 1 | 4.82; 9.782; 15.323 90; 93.407; 90 | 721.19 | Acuña-Cueva, Esther R.; Faure, René; Jiménez-Pulido, Sonia B.; Moreno-Carretero, Miguel N.; Peña-Ruiz, Tomás Study of the chelating capacity of nucleobase analogs with biological interest: XRD structural study and ab initio molecular orbital calculations on 1-methyl and 1,6,7-trimethyllumazine Journal of Molecular Structure, 2004, 697, 65 |
| 1549449 | CIF | C9 H10 N4 O2 | C 1 2 1 | 16.136; 6.585; 10.538 90; 125.15; 90 | 915.54 | Acuña-Cueva, Esther R.; Faure, René; Jiménez-Pulido, Sonia B.; Moreno-Carretero, Miguel N.; Peña-Ruiz, Tomás Study of the chelating capacity of nucleobase analogs with biological interest: XRD structural study and ab initio molecular orbital calculations on 1-methyl and 1,6,7-trimethyllumazine Journal of Molecular Structure, 2004, 697, 65 |
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