Information card for entry 2000959

Structure parameters

• Formula: C24 H31 F O3
• Calculated formula: C24 H31 F O3
• SMILES: Fc1c(cc(C2=C(/C=C/[C@H]3OC(=O)C[C@@H](O)C3)C(CC(C2)(C)C)(C)C)cc1)C.Fc1c(cc(C2=C(/C=C/[C@@H]3OC(=O)C[C@H](O)C3)C(CC(C2)(C)C)(C)C)cc1)C
• Title of publication: Structure of RG-12561 dichloromethane solvate and a diastereomer
• Authors of publication: Ammon, H. L.; Prasad, S. M.; Kumar, N.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 4
• Pages of publication: 669 - 675
• a: 6.054 ± 0.002 Å
• b: 12.931 ± 0.002 Å
• c: 14.838 ± 0.003 Å
• α: 67.7 ± 0.02°
• β: 85.75 ± 0.02°
• γ: 82.85 ± 0.02°
• Cell volume: 1065.9 ± 0.5 ų
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No