Information card for entry 2006672

Structure parameters

• Chemical name: 2-(3-Indolyl)cyclohexanespiro-5'-hydantoin
• Formula: C16 H19 N3 O3
• Calculated formula: C16 H19 N3 O3
• Title of publication: Two Cyclohexanespiro-5'-hydantoin Monohydrates
• Authors of publication: Gauthier, Ted J.; Yokum, T. Scott; Morales, Guillermo A.; McLaughlin, Mark L.; Liu, Yen-Hsiang; Fronczek, Frank R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 1659 - 1661
• a: 11.991 ± 0.001 Å
• b: 8.3535 ± 0.0007 Å
• c: 15.159 ± 0.001 Å
• α: 90°
• β: 94.731 ± 0.008°
• γ: 90°
• Cell volume: 1513.3 ± 0.2 ų
• Cell temperature: 296 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.088
• Goodness-of-fit parameter for significantly intense reflections: 1.533
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No