Information card for entry 4132316

Structure parameters

• Chemical name: PG-167.3
• Formula: C79 H118 B4 Mo4 N24 O8 P2 Si2
• Calculated formula: C79 H118 B4 Mo4 N24 O8 P2 Si2
• Title of publication: Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M.
• Authors of publication: Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 23
• Pages of publication: 7187 - 7198
• a: 11.9565 ± 0.0016 Å
• b: 25.378 ± 0.004 Å
• c: 16.08 ± 0.002 Å
• α: 90°
• β: 104.783 ± 0.005°
• γ: 90°
• Cell volume: 4717.7 ± 1.1 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0771
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1176
• Weighted residual factors for all reflections included in the refinement: 0.1321
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No