Information card for entry 7129820

Structure parameters

• Formula: C34 H42 Cl3 N2 V
• Calculated formula: C34 H42 Cl3 N2 V
• Title of publication: Vanadium complexes with N-heterocyclic vinylidene ligands
• Authors of publication: Kooij, Bastiaan; Dong, Zhaowen; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Piveteau, Laura; Severin, Kay
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 16.7785 ± 0.0003 Å
• b: 9.2915 ± 0.00018 Å
• c: 22.4036 ± 0.0004 Å
• α: 90°
• β: 103.312 ± 0.002°
• γ: 90°
• Cell volume: 3398.82 ± 0.11 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0499
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No