Information card for entry 2003979

Structure parameters

• Chemical name: S-benzyl-β-N-(dimethylaminophenyl)methylendithiocarbazate.
• Formula: C17 H19 N3 S2
• Calculated formula: C17 H19 N3 S2
• Title of publication: Benzyl 3-(4-Dimethylaminobenzylidene)dithiocarbazate
• Authors of publication: Fun, H.-K.; Sivakumar, K.; Yip, B.-C.; Tian, Y.-P.; Duan, C.-Y.; Lu, Z.-L.; You, X.-Z.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 10
• Pages of publication: 2080 - 2083
• a: 10.431 ± 0.002 Å
• b: 13.477 ± 0.002 Å
• c: 15.016 ± 0.004 Å
• α: 109.56 ± 0.02°
• β: 101.56 ± 0.02°
• γ: 109.14 ± 0.01°
• Cell volume: 1761.4 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0657
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for all reflections: 0.1382
• Weighted residual factors for significantly intense reflections: 0.1278
• Goodness-of-fit parameter for all reflections: 1.049
• Goodness-of-fit parameter for significantly intense reflections: 1.169
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No