Information card for entry 2010210

Structure parameters

• Formula: C27 H22 N2 O2
• Calculated formula: C27 H22 N2 O2
• SMILES: O=C(c1ccccc1)c1ccc(cc1)NCNc1ccc(cc1)C(=O)c1ccccc1
• Title of publication: 4,4'-Methylenediiminobis(benzophenone)
• Authors of publication: He, Y.; Su, G.; Shi, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 11
• Pages of publication: 1786 - 1788
• a: 10.003 ± 0.002 Å
• b: 14.636 ± 0.003 Å
• c: 28.724 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4205.3 ± 1.6 ų
• Cell temperature: 296 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.082
• Goodness-of-fit parameter for significantly intense reflections: 1.63
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No