Information card for entry 4301480

Structure parameters

• Common name: Cp'Mn(CO)2(η^2^-HSiHPh2)
• Formula: C20 H19 Mn O2 Si
• Calculated formula: C20 H19 Mn O2 Si
• SMILES: [Mn]12345([SiH](c6ccccc6)(c6ccccc6)[H]5)(C#[O])(C#[O])[cH]5[cH]1[cH]2[cH]3[c]45C
• Title of publication: Nature of the Bonding in Metal-Silane σ-Complexes
• Authors of publication: G. Sean McGrady; Peter Sirsch; Nicholas P. Chatterton; Andreas Ostermann; Carlo Gatti; Sandra Altmannshofer; Verena Herz; Georg Eickerling; Wolfgang Scherer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 1588 - 1598
• a: 8.475 ± 0.0005 Å
• b: 15.1016 ± 0.001 Å
• c: 14.8686 ± 0.001 Å
• α: 90°
• β: 105.425 ± 0.0033°
• γ: 90°
• Cell volume: 1834.4 ± 0.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• 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: 0.1243
• Residual factor for significantly intense reflections: 0.0716
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.1762
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation probe: neutron
• Diffraction radiation wavelength: 1.23 Å
• Diffraction radiation type: neutron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No