Information card for entry 2211627

Structure parameters

• Common name: 1-naphthyl-4-phenylcyclohexene
• Chemical name: 1-naphthyl-4-phenylcyclohexene
• Formula: C22 H20
• Calculated formula: C22 H20
• SMILES: c1ccccc1C1CC=C(CC1)c1cccc2ccccc12
• Title of publication: 1-Naphthyl-4-phenylcyclohexene
• Authors of publication: M. Periasamy; Sudha Soundirapandian; S. Athimoolam; A. Ponnusamy; S. Natarajan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: o5651 - o5653
• a: 17.194 ± 0.0011 Å
• b: 7.476 ± 0.0006 Å
• c: 13.795 ± 0.0008 Å
• α: 90°
• β: 112.99 ± 0.02°
• γ: 90°
• Cell volume: 1632.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1003
• Residual factor for significantly intense reflections: 0.0656
• Weighted residual factors for significantly intense reflections: 0.1915
• Weighted residual factors for all reflections included in the refinement: 0.221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes