Information card for entry 4307893

Structure parameters

• Formula: C22 H38 N6 O4 S2 V2
• Calculated formula: C22 H38 N6 O4 S2 V2
• SMILES: c1(ccc(cc1)C)S(=O)(=O)N1[V]2(N(C)C)(N(S(=O)(=O)c3ccc(cc3)C)[V]12(N(C)C)N(C)C)N(C)C
• Title of publication: Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals
• Authors of publication: Christian Lorber; Robert Choukroun; Laure Vendier
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3192 - 3202
• a: 8.0142 ± 0.0005 Å
• b: 8.8093 ± 0.0008 Å
• c: 20.0954 ± 0.0014 Å
• α: 90°
• β: 94.02 ± 0.008°
• γ: 90°
• Cell volume: 1415.23 ± 0.19 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 6
• 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: 0.0335
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No