Information card for entry 8101087

Structure parameters

• Formula: C57 H45 Cl6 N O7
• Calculated formula: C57 H45 Cl6 N O7
• SMILES: ClC(Cl)Cl.ClC(Cl)Cl.O=C1N(CCOC)C(=O)C23C1([C@H]1O[C@@H]3[C@@H]3[C@@]4(O[C@](c5c4cccc5)(c4ccccc4)[C@H]13)c1ccccc1)[C@@H]1O[C@H]2[C@@H]2[C@H]1[C@@]1(O[C@]2(c2c1cccc2)c1ccccc1)c1ccccc1
• Title of publication: Crystal structure of (1α,2β,3α,4β,5α, 12α,13β,14α,15β,16α,17β,18α, 25α,26β)-N-(2-methoxyethyl)-5,12,18,25-tetraphenyl-27, 28,29,30-tetraoxadeca-cyclo-[14.10.1.1^3,14^.1^5,12^.1^18,25^.0^2, 15^.0^4,13^.0^6,11^.0^17,26^.0^19,24^]triaconta-6,8,10,19,21,23-exaen- 2,15-carboximide—chloroform (1/2), C~55~H~43~NO~7 ~· 2CHCl~3~
• Authors of publication: Wang, S.; Warrener, R. N.; Russell, R. A.; Tiekink, E. R. T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 4
• Pages of publication: 535 - 537
• a: 18.675 ± 0.009 Å
• b: 23.928 ± 0.008 Å
• c: 11.356 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5074 ± 4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No