Information card for entry 7130049

Structure parameters

• Formula: C126 H154 N4 O5 P2 Si2 Zn2
• Calculated formula: C126 H154 N4 O5 P2 Si2 Zn2
• Title of publication: Thermally stable zinc hydride catalyst for hydrosilylation of CO2 to silyl formate at atmospheric pressure
• Authors of publication: Baalbaki, Hassan A.; Shu, Julia; Nyamayaro, Kudzanai; Jung, Hyuk-Joon; Mehrkhodavandi, Parisa
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 11.048 ± 0.002 Å
• b: 14.012 ± 0.003 Å
• c: 19.725 ± 0.004 Å
• α: 80.978 ± 0.007°
• β: 87.207 ± 0.006°
• γ: 69.507 ± 0.006°
• Cell volume: 2824.8 ± 1 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0424
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No