Information card for entry 1515953

Structure parameters

• Formula: C31 H30 O
• Calculated formula: C31 H30 O
• SMILES: O=C(C(c1ccc(cc1)c1ccccc1)(C)C)C(c1ccc(cc1)c1ccccc1)(C)C
• Title of publication: Photolysis of an asymmetrically substituted diazene in solution and in the crystalline state.
• Authors of publication: Hoijemberg, Pablo Ariel; Karlen, Steven D.; Sanramé, Carlos Norberto; Aramendía, Pedro Francisco; García-Garibay, Miguel Angel
• Journal of publication: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
• Year of publication: 2009
• Journal volume: 8
• Journal issue: 7
• Pages of publication: 961 - 969
• a: 8.1279 ± 0.0009 Å
• b: 6.3065 ± 0.0007 Å
• c: 22.035 ± 0.002 Å
• α: 90°
• β: 97.416 ± 0.002°
• γ: 90°
• Cell volume: 1120 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 3
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0428
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No