Information card for entry 2226084

Structure parameters

• Chemical name: 8-(4-Chlorobenzylidene)-4-(4-chlorophenyl)-2-phenyl-5,6,7,8-tetrahydroquinoline
• Formula: C28 H21 Cl2 N
• Calculated formula: C28 H21 Cl2 N
• SMILES: Clc1ccc(cc1)/C=C1\CCCc2c1nc(c1ccccc1)cc2c1ccc(Cl)cc1
• Title of publication: 8-(4-Chlorobenzylidene)-4-(4-chlorophenyl)-2-phenyl-5,6,7,8-tetrahydroquinoline
• Authors of publication: Jian, Fangfang; Zhai, Xin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: o1423
• a: 10.0583 ± 0.001 Å
• b: 10.6483 ± 0.001 Å
• c: 10.8792 ± 0.001 Å
• α: 82.028 ± 0.002°
• β: 89.345 ± 0.001°
• γ: 71.335 ± 0.002°
• Cell volume: 1092.58 ± 0.18 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0445
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes