Information card for entry 1552514

Structure parameters

• Formula: C25 H52 Mn N P4 Si
• Calculated formula: C25.0012 H52.0032 Mn N P4.0004 Si
• SMILES: C(#[N]c1c(cccc1C)C)[Mn]12([SiH2]CCCC)([P](C)(C)CC[P]1(C)C)[P](C)(C)CC[P]2(C)C
• 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: 17.3395 ± 0.001 Å
• b: 18.5712 ± 0.001 Å
• c: 19.5632 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6299.7 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1117
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.1787
• Weighted residual factors for all reflections included in the refinement: 0.1859
• Goodness-of-fit parameter for all reflections included in the refinement: 1.227
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No