Information card for entry 7710654

Structure parameters

• Formula: C2.9 H4.2 Cl0.2 N0.1 V0.1
• Calculated formula: C2.9 H4.2 Cl0.2 N0.1 V0.1
• Title of publication: N-Heterocyclic Carbene and Cyclic (Alkyl)(amino)carbene Complexes of Vanadium(III) and Vanadium(V)
• Authors of publication: Horrer, Günther; Mann, Sophie; Krummenacher, Ivo; Braunschweig, Holger; Radius, Udo
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.9087 ± 0.0002 Å
• b: 10.3756 ± 0.0002 Å
• c: 14.9101 ± 0.0003 Å
• α: 110.238 ± 0.002°
• β: 92.849 ± 0.002°
• γ: 103.498 ± 0.002°
• Cell volume: 1384.16 ± 0.05 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0385
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.1
• Weighted residual factors for all reflections included in the refinement: 0.1009
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No