Crystallography Open Database
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Result: there are 158 entries in the selection
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Searching journal of publication like 'Acta Crystallographica, Section B' volume of publication is 74
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
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2108280 | CIF HKL | C10 H8 | P 1 21/a 1 | 7.7154; 5.9019; 7.6969 90; 100.411; 90 | 344.712 | Dittrich, B.; Fabbiani, F. P. A.; Henn, J.; Schmidt, M. U.; Macchi, P.; Meindl, K.; Spackman, M. A. Azulene revisited: solid-state structure, invariom modeling and lattice-energy minimization of a classical example of disorder Acta Crystallographica Section B, 2018, 74 |
2108281 | CIF HKL | C18 H24 Au Fe P | P b c a | 13.8822; 11.6188; 22.115 90; 90; 90 | 3567 | Makal, Anna Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I) Acta Crystallographica Section B, 2018, 74 |
2108282 | CIF HKL | C18 H24 Au Fe P | P b c a | 13.8732; 11.6316; 22.124 90; 90; 90 | 3570.1 | Makal, Anna Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I) Acta Crystallographica Section B, 2018, 74 |
2108283 | CIF HKL | C18 H24 Au Fe P | P b 21 a | 13.872; 11.644; 21.96 90; 90; 90 | 3547 | Makal, Anna Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I) Acta Crystallographica Section B, 2018, 74 |
2108284 | CIF HKL | C18 H24 Au Fe P | P b c a | 14.0011; 11.6244; 21.893 90; 90; 90 | 3563.2 | Makal, Anna Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I) Acta Crystallographica Section B, 2018, 74 |
2108285 | CIF HKL Paper | C14 H8 F3 O | P 1 21/c 1 | 23.238; 7.5293; 6.2437 90; 92.83; 90 | 1091.1 | Sonina, Alina A.; Koskin, Igor P.; Sherin, Peter S.; Rybalova, Tatyana V.; Shundrina, Inna K.; Mostovich, Evgeny A.; Kazantsev, Maxim S. Crystal packing control of a trifluoromethyl-substituted furan/phenylene co-oligomer Acta Crystallographica Section B, 2018, 74 |
2108286 | CIF HKL Paper | C14 H8 F3 O | P 1 21/c 1 | 11.505; 6.235; 16.0118 90; 109.293; 90 | 1084.08 | Sonina, Alina A.; Koskin, Igor P.; Sherin, Peter S.; Rybalova, Tatyana V.; Shundrina, Inna K.; Mostovich, Evgeny A.; Kazantsev, Maxim S. Crystal packing control of a trifluoromethyl-substituted furan/phenylene co-oligomer Acta Crystallographica Section B, 2018, 74 |
2108287 | CIF HKL Paper | C28 H16 F6 O2 | P 1 21/c 1 | 20.5435; 6.2569; 35.797 90; 106.649; 90 | 4408.4 | Sonina, Alina A.; Koskin, Igor P.; Sherin, Peter S.; Rybalova, Tatyana V.; Shundrina, Inna K.; Mostovich, Evgeny A.; Kazantsev, Maxim S. Crystal packing control of a trifluoromethyl-substituted furan/phenylene co-oligomer Acta Crystallographica Section B, 2018, 74 |
2108288 | CIF HKL | C6 H2 Cl4 | P 1 21/c 1 | 3.8682; 14.9766; 13.4758 90; 90.378; 90 | 780.67 | Bujak, Maciej Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding Acta Crystallographica Section B, 2018, 74, 458-466 |
2108289 | CIF HKL | C6 H2 Cl4 | P 1 21/c 1 | 3.79937; 14.8635; 13.3272 90; 89.674; 90 | 752.6 | Bujak, Maciej Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding Acta Crystallographica Section B, 2018, 74, 458-466 |
2108290 | CIF HKL | C6 H2 Cl4 | P 1 21/c 1 | 3.83433; 23.9377; 17.2355 90; 94.293; 90 | 1577.52 | Bujak, Maciej Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding Acta Crystallographica Section B, 2018, 74, 458-466 |
2108291 | CIF HKL | C6 H2 Cl4 | P 1 21/c 1 | 3.76927; 23.6053; 17.174 90; 94.902; 90 | 1522.46 | Bujak, Maciej Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding Acta Crystallographica Section B, 2018, 74, 458-466 |
2108292 | CIF HKL | C12 H24 Ca O15 | P 21 21 21 | 6.71198; 13.3641; 19.5439 90; 90; 90 | 1753.08 | Bugris, V.; Dudás, Cs.; Kutus, B.; Harmat, V.; Csankó, K.; Brockhauser, S.; Pálinkó, I.; Turner, Peter; Sipos, P. Crystal and solution structures of calcium complexes relevant to problematic waste disposal: calcium gluconate and calcium isosaccharinate Acta Crystallographica Section B, 2018, 74 |
2108293 | CIF HKL | C12 H22 Ca O12 | P 21 21 2 | 6.7573; 19.5874; 5.7344 90; 90; 90 | 758.99 | Bugris, V.; Dudás, Cs.; Kutus, B.; Harmat, V.; Csankó, K.; Brockhauser, S.; Pálinkó, I.; Turner, Peter; Sipos, P. Crystal and solution structures of calcium complexes relevant to problematic waste disposal: calcium gluconate and calcium isosaccharinate Acta Crystallographica Section B, 2018, 74 |
2108294 | CIF | C13 H11 N3 O2 | P 1 21/c 1 | 8.4553; 10.1812; 13.408 90; 98.646; 90 | 1141.1 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
2108295 | CIF | C13 H13 N3 O3 | P b c a | 7.0488; 12.15; 28.649 90; 90; 90 | 2453.6 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
2108296 | CIF Paper | C13 H10 I N3 O | P -1 | 10.0223; 11.1984; 12.4505 109.836; 101.25; 97.494 | 1259.58 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
2108297 | CIF | C15 H11 I N4 | I 41 | 15.0197; 15.0197; 12.8791 90; 90; 90 | 2905.41 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
2108298 | CIF | C15 H11 Br N4 | P 1 21/c 1 | 14.8761; 4.0269; 23.183 90; 105.81; 90 | 1336.23 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
2108299 | CIF | C16 H14 Cl2 N4 O | P 1 21/c 1 | 9.51859; 15.70955; 21.6869 90; 98.0651; 90 | 3210.83 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
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