Information card for entry 2008584

Structure parameters

• Formula: C22 H32 Mo N2
• Calculated formula: C22 H32 Mo N2
• SMILES: [Mo]([N]C(C)(C)C)([N]C(C)(C)C)(Cc1ccccc1)Cc1ccccc1
• Title of publication: Dibenzylbis(<i>tert</i>-butylimido)molybdenum(VI), containing both η^1^- and η^2^-benzyl ligands
• Authors of publication: Clegg, William; Elsegood, Mark R. J.; Dyer, Philip W.; Gibson, Vernon C.; Marshall, Edward L.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 6
• Pages of publication: 916 - 918
• a: 9.733 ± 0.003 Å
• b: 17.579 ± 0.004 Å
• c: 13.016 ± 0.003 Å
• α: 90°
• β: 97.12 ± 0.02°
• γ: 90°
• Cell volume: 2209.8 ± 1 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 4
• 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: 0.02
• Residual factor for significantly intense reflections: 0.018
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes