Information card for entry 4087835

Structure parameters

• Formula: C62 H54 Br O2.5 P3 Si W
• Calculated formula: C62 H54 Br O2.5 P3 Si W
• Title of publication: Synthesis of a Stable Methylidyne Complex
• Authors of publication: Hill, Anthony F.; Ward, Jas S.; Xiong, Yaoyao
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 20
• Pages of publication: 5057
• a: 15.2616 ± 0.0002 Å
• b: 18.3376 ± 0.0002 Å
• c: 19.1608 ± 0.0002 Å
• α: 90°
• β: 94.3896 ± 0.0008°
• γ: 90°
• Cell volume: 5346.63 ± 0.11 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.0747
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for all reflections: 0.1313
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.1313
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9326
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No