Information card for entry 1552513

Structure parameters

• Formula: C27 H48 Mn N P4 Si
• Calculated formula: C27 H48 Mn N P4 Si
• SMILES: C(#[N]c1c(cccc1C)C)[Mn]12([P](C)(C)CC[P]1(C)C)([P](C)(C)CC[P]2(C)C)[SiH2]c1ccccc1
• Title of publication: Interconversion and reactivity of manganese silyl, silylene, and silene complexes
• Authors of publication: Price, Jeffrey S.; Emslie, David J. H.
• Journal of publication: Chemical Science
• Year of publication: 2019
• a: 11.0996 ± 0.0002 Å
• b: 18.7393 ± 0.0004 Å
• c: 15.7941 ± 0.0004 Å
• α: 90°
• β: 106.78 ± 0.001°
• γ: 90°
• Cell volume: 3145.27 ± 0.12 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0473
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No