Information card for entry 2012225

Structure parameters

• Chemical name: (μ-dicyclohexylphosphine)-heptacarbonyl-eq-triphenylphosphine- triphenylphosphine-silver-manganese-rhenium
• Formula: C55 H52 Ag Mn O7 P3 Re
• Calculated formula: C55 H52 Ag Mn O7 P3 Re
• SMILES: [Re]12([P]([Mn]13(C#[O])(C#[O])(C#[O])C(=O)[Ag]23[P](c1ccccc1)(c1ccccc1)c1ccccc1)(C1CCCCC1)C1CCCCC1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O]
• Title of publication: The first example of a silver‒manganese‒rhenium cluster complex: heptacarbonyl-1κ^3^<i>C</i>,2κ^4^<i>C</i>-μ-dicyclohexylphosphido-1:2κ^2^<i>P</i>-bis(triphenylphosphine)-1κ<i>P</i>,3κ<i>P</i>-<i>triangulo</i>-manganeserheniumsilver with disordered solvent
• Authors of publication: Flörke, Ulrich; Petters, Dina
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 9
• Pages of publication: 1044 - 1045
• a: 11.583 ± 0.001 Å
• b: 12.842 ± 0.002 Å
• c: 20.728 ± 0.003 Å
• α: 96.7 ± 0.01°
• β: 98.76 ± 0.01°
• γ: 113.2 ± 0.01°
• Cell volume: 2747.4 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for all reflections included in the refinement: 0.0866
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No