Information card for entry 1566981

Structure parameters

• Formula: C79 H120 Mg2 N4 O2 Rh
• Calculated formula: C79 H120 Mg2 N4 O2 Rh
• Title of publication: Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation.
• Authors of publication: Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R.
• Journal of publication: Chemical science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 22
• Pages of publication: 6592 - 6598
• a: 14.0176 ± 0.0004 Å
• b: 13.9077 ± 0.0005 Å
• c: 40.2691 ± 0.001 Å
• α: 90°
• β: 99.749 ± 0.003°
• γ: 90°
• Cell volume: 7737.2 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0652
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No