Information card for entry 1569925

Structure parameters

• Formula: C128 H182 Cl4 Ga4 N4 O P4 Si4
• Calculated formula: C128 H182 Cl4 Ga4 N4 O P4 Si4
• Title of publication: On the σ-complex character of bis(gallyl)/digallane transition metal species.
• Authors of publication: Kalkuhl, Till L.; Qin, Lei; Zhao, Lili; Frenking, Gernot; Hadlington, Terrance J.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 40
• Pages of publication: 11088 - 11095
• a: 23.09 ± 0.005 Å
• b: 27.34 ± 0.006 Å
• c: 22.52 ± 0.005 Å
• α: 90°
• β: 111.9 ± 0.03°
• γ: 90°
• Cell volume: 13191 ± 6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• 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: 0.1432
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.123
• Goodness-of-fit parameter for all reflections included in the refinement: 0.877
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No