Information card for entry 7117646

Structure parameters

• Formula: C76 H180 K2 Mn2 O18 Si12
• Calculated formula: C76 H180 K2 Mn2 O18 Si12
• Title of publication: Salts of the two-coordinate homoleptic manganese(I) dialkyl anion [Mn{C(SiMe3)3}2]^-^ with quenched orbital magnetism
• Authors of publication: C.-Y. Lin; J. C. Fettinger; N. F. Chilton; A. Formanuik; F. Grandjean; G. J. Long; P. P. Power
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 13275
• a: 12.5416 ± 0.0007 Å
• b: 16.0775 ± 0.0009 Å
• c: 27.2358 ± 0.0015 Å
• α: 87.785 ± 0.001°
• β: 85.0576 ± 0.001°
• γ: 79.8209 ± 0.001°
• Cell volume: 5383.7 ± 0.5 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1033
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No