Information card for entry 2104511

Structure parameters

• Chemical name: (5S)-((4S-n-Butylcarbamoyl-1-ethyl-5-oxopyrrolidin-(3R)-yl)-isobutyl- 2,2-dimethyloxazolidine-3-carboxylic acid t-butyl ester
• Formula: C25 H45 N3 O5
• Calculated formula: C25 H45 N3 O5
• SMILES: O=C1N(C[C@@H]([C@H]1C(=O)NCCCC)[C@@H]1OC(N([C@H]1CC(C)C)C(=O)OC(C)(C)C)(C)C)CC.O=C1N(C[C@H]([C@@H]1C(=O)NCCCC)[C@H]1OC(N([C@@H]1CC(C)C)C(=O)OC(C)(C)C)(C)C)CC
• Title of publication: Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
• Authors of publication: Marsh, Richard E.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: 782 - 783
• a: 23.472 ± 0.009 Å
• b: 15.475 ± 0.004 Å
• c: 19.37 ± 0.004 Å
• α: 90°
• β: 125.82 ± 0.02°
• γ: 90°
• Cell volume: 5705 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No