Information card for entry 1100895

Structure parameters

• Chemical name: [Nb(NtBu){MeC(2-C5H4N)(CH2NSiMe3)(CH2NC(OSiMe3)NtBu)}Cl]
• Formula: C24 H47 Cl N5 Nb O Si2
• Calculated formula: C24 H47 Cl N5 Nb O Si2
• Title of publication: Reactions of Neutral and Cationic Diamide-Supported Imido Complexes with CO ₂ and Other Heterocumulenes: Issues of Site Selectivity
• Authors of publication: Ward, Benjamin D.; Orde, Gavin; Clot, Eric; Cowley, Andrew R.; Gade, Lutz H.; Mountford, Philip
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 10
• Pages of publication: 2368 - 2385
• a: 16.8425 ± 0.0003 Å
• b: 21.51 ± 0.0004 Å
• c: 36.4135 ± 0.0007 Å
• α: 90°
• β: 100.741 ± 0.0006°
• γ: 90°
• Cell volume: 12960.8 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for all reflections included in the refinement: 0.0501
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0441
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No