Information card for entry 2009009

Structure parameters

• Chemical name: bis((μ^2^-Isopropoxo)-di-isopropoxy-4-Methylphenylimido-vanadium(v))
• Formula: C32 H56 N2 O6 V2
• Calculated formula: C32 H56 N2 O6 V2
• SMILES: [V]1(=Nc2ccc(cc2)C)(OC(C)C)([O](C(C)C)[V](=Nc2ccc(cc2)C)(OC(C)C)([O]1C(C)C)OC(C)C)OC(C)C
• Title of publication: The twinned structure of the μ-isopropoxidodiisopropoxido(<i>p</i>-tolylimido)vanadium(V) dimer, twin refinement against CCD area-detector data
• Authors of publication: Lutz, Martin; Hagen, Henk; Schreurs, Antoine M.M.; Spek, Anthony L.; van Koten, Gerard
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 1636 - 1639
• a: 9.7491 ± 0.0006 Å
• b: 10.0291 ± 0.0006 Å
• c: 11.1681 ± 0.0005 Å
• α: 85.297 ± 0.004°
• β: 71.869 ± 0.004°
• γ: 61.3013 ± 0.0018°
• Cell volume: 907.28 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.085
• Residual factor for significantly intense reflections: 0.07
• Weighted residual factors for all reflections included in the refinement: 0.174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.186
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes