Information card for entry 4336187

Structure parameters

• Formula: C92 H106 Cl O7 V
• Calculated formula: C92 H106 Cl O7 V
• Title of publication: 3d Early Transition Metal Complexes Supported by a New Sterically Demanding Aryloxide Ligand
• Authors of publication: Keith Searles; Ba L. Tran; Maren Pink; Chun-Hsing Chen; Daniel J. Mindiola
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11126 - 11135
• a: 23.298 ± 0.002 Å
• b: 15.8883 ± 0.0014 Å
• c: 23.727 ± 0.002 Å
• α: 90°
• β: 115.921 ± 0.002°
• γ: 90°
• Cell volume: 7899.3 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.102
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1387
• Weighted residual factors for all reflections included in the refinement: 0.1607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No