Information card for entry 7042386

Structure parameters

• Common name: DEP-03-529-1b
• Formula: C29 H40.5 B F4 N5.5 O Re
• Calculated formula: C29 H40.5 B F4 N5.5 O Re
• Title of publication: Cationic rhenium(iii) complexes: synthesis, characterization, and reactivity for hydrosilylation of aldehydes.
• Authors of publication: Pérez, Damaris E; Smeltz, Jessica L.; Sommer, Roger D.; Boyle, Paul D.; Ison, Elon A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 14
• Pages of publication: 4609 - 4616
• a: 22.3852 ± 0.0005 Å
• b: 14.7691 ± 0.0003 Å
• c: 19.6678 ± 0.0005 Å
• α: 90°
• β: 104.123 ± 0.001°
• γ: 90°
• Cell volume: 6305.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0495
• Weighted residual factors for all reflections included in the refinement: 0.0542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No