Information card for entry 2227619

Structure parameters

• Chemical name: <i>N</i>-[11-(4-Chlorophenyl)-11,12- dihydrobenzo[<i>c</i>]phenanthridin-6-yl]benzamide
• Formula: C30 H21 Cl N2 O
• Calculated formula: C30 H21 Cl N2 O
• SMILES: Clc1ccc(cc1)C1Cc2ccccc2c2c1c1ccccc1c(n2)NC(=O)c1ccccc1
• Title of publication: <i>N</i>-[11-(4-Chlorophenyl)-11,12-dihydrobenzo[<i>c</i>]phenanthridin-6-yl]benzamide
• Authors of publication: Zhang, Min; Wu, Xiang-Yang; Yang, Liu-Qing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2973 - o2974
• a: 26.567 ± 0.005 Å
• b: 9.6752 ± 0.0019 Å
• c: 17.329 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4454.3 ± 1.6 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0428
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes