Information card for entry 7127968

Structure parameters

• Chemical name: (MeSiP2)Co(CNtBu)2
• Formula: C35 H57 Co N2 P2 Si
• Calculated formula: C35 H57 Co N2 P2 Si
• Title of publication: Metal-ligand cooperative transformation of alkyl azide to isocyanate occurring at a Co-Si moiety.
• Authors of publication: So, Jongho; Kim, Seji; Cho, Kyung-Bin; Lee, Yunho
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 26
• Pages of publication: 3219 - 3222
• a: 10.618 ± 0.002 Å
• b: 19.666 ± 0.004 Å
• c: 18.29 ± 0.003 Å
• α: 90°
• β: 106.87°
• γ: 90°
• Cell volume: 3654.8 ± 1.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• 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: 0.0562
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.1018
• Weighted residual factors for all reflections included in the refinement: 0.1084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No