Information card for entry 1558470

Structure parameters

• Common name: 6,9-methano-7,9b-diphenyl-1,2,3,5a,6,7,8,9,9a,9b-decahydroimidazo [2,1-a]isoindol-5-one
• Formula: C23 H24 N2 O
• Calculated formula: C23 H24 N2 O
• SMILES: O=C1N2CCN[C@@]2([C@@H]2[C@H]1[C@@H]1[C@H](C[C@H]2C1)c1ccccc1)c1ccccc1.O=C1N2CCN[C@]2([C@H]2[C@@H]1[C@H]1[C@@H](C[C@@H]2C1)c1ccccc1)c1ccccc1
• Title of publication: X-Ray Structure Determination of a Saturated Methylene-bridged Diphenylimidazo[2,1-a]isoindolone
• Authors of publication: Stajer, Geza; Sillanpaa, Reijo; Pihlaja, Kalevi
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1994
• Journal volume: 48
• Pages of publication: 603 - 605
• a: 7.668 ± 0.002 Å
• b: 23.038 ± 0.003 Å
• c: 10.2654 ± 0.0008 Å
• α: 90°
• β: 94.65 ± 0.01°
• γ: 90°
• Cell volume: 1807.5 ± 0.5 ų
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No