Information card for entry 2206795

Structure parameters

• Chemical name: N-(N-Phenylbenzimidoyl)thiobenzanilide
• Formula: C26 H20 N2 S
• Calculated formula: C26 H20 N2 S
• SMILES: S=C(N(c1ccccc1)\C(=N/c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: <i>N</i>-(<i>N</i>-Phenylbenzimidoyl)thiobenzanilide
• Authors of publication: Naumov, Panc̆e; Ristovska, Natas̆a; Anastasova, Frosa; Ng, Seik Weng
• Journal of publication: Acta Crystallographica, Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: o3036 - o3037
• a: 11.0162 ± 0.0012 Å
• b: 19.98 ± 0.002 Å
• c: 9.5802 ± 0.001 Å
• α: 90°
• β: 99.092 ± 0.003°
• γ: 90°
• Cell volume: 2082.1 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.106
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.131
• Weighted residual factors for all reflections included in the refinement: 0.153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No