Information card for entry 4304613

Structure parameters

• Formula: C72 H96 Mg4 O6 P8
• Calculated formula: C72 H96 Mg4 O6 P8
• SMILES: [Mg]123([PH](c4ccccc4)[Mg]([PH]([Mg]([PH]1c1ccccc1)(Pc1ccccc1)[O]1CCCC1)c1ccccc1)([PH]2c1ccccc1)([PH]([Mg](Pc1ccccc1)([PH]3c1ccccc1)[O]1CCCC1)c1ccccc1)([O]1CCCC1)[O]1CCCC1)([O]1CCCC1)[O]1CCCC1
• Title of publication: Arylphosphanide Complexes of the Alkaline-Earth Metals Magnesium, Calcium, Strontium, and Barium of the Formula (THF)nM[P(H)Ph]2 and Formation of Potassium Diphenylphosphinomagnesiates
• Authors of publication: Martin Gärtner; Helmar Görls; Matthias Westerhausen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 1397 - 1405
• a: 13.4719 ± 0.0008 Å
• b: 13.6066 ± 0.0009 Å
• c: 13.6413 ± 0.0009 Å
• α: 60.518 ± 0.003°
• β: 85.434 ± 0.003°
• γ: 63.506 ± 0.003°
• Cell volume: 1916.5 ± 0.2 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1642
• Residual factor for significantly intense reflections: 0.0673
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.1743
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No