Information card for entry 7001589

Structure parameters

• Formula: C18 H14 Mn2 O6 P4
• Calculated formula: C18 H14 Mn2 O6 P4
• SMILES: c12c(cccc1)[PH]1[Mn](C#[O])(C#[O])(C#[O])([PH2]2)[PH]2c3c(cccc3)[PH2][Mn]12(C#[O])(C#[O])C#[O]
• Title of publication: Manganese complexes of phosphino-μ-phosphido ligands
• Authors of publication: Edwards, Peter G.; Hahn, F. Ekkehardt; Limon, Matthieu; Newman, Paul D.; Kariuki, Benson M.; Stasch, Andreas
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 26
• Pages of publication: 5115 - 5119
• a: 21.671 ± 0.0004 Å
• b: 21.671 ± 0.0004 Å
• c: 19.131 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8984.5 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0897
• Weighted residual factors for all reflections included in the refinement: 0.0968
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No