Information card for entry 7702568

Structure parameters

• Formula: C64 H53 Cl2 Nb O2 Si
• Calculated formula: C64 H53 Cl2 Nb O2 Si
• Title of publication: Studies of the alkylation of niobium and tantalum halides containing 2,6-diarylphenoxide ancillary ligation
• Authors of publication: Schweiger, Scott W.; Salberg, Michelle M.; Pulvirenti, April L.; Freeman, Emily E.; Fanwick, Phillip E.; Rothwell, Ian P.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 13
• Pages of publication: 2020
• a: 9.9783 ± 0.0004 Å
• b: 12.5003 ± 0.0006 Å
• c: 22.6124 ± 0.0013 Å
• α: 97.143 ± 0.003°
• β: 91.442 ± 0.003°
• γ: 108.89 ± 0.003°
• Cell volume: 2641.4 ± 0.2 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No