Information card for entry 2200278

Structure parameters

• Chemical name: Bis(μ-diphenylphosphido)bis{trans-tricarbonylbis[1-(4- ethoxybutoxy)pentylidene]rhenium}
• Formula: C52 H64 O10 P2 Re2
• Calculated formula: C52 H64 O10 P2 Re2
• SMILES: C(#[O])[Re]1(C#[O])(C#[O])(=C(OCCCCOCC)CCCC)[P](c2ccccc2)(c2ccccc2)[Re](C#[O])(C#[O])(C#[O])(=C(OCCCCOCC)CCCC)[P]1(c1ccccc1)c1ccccc1
• Title of publication: Bis(μ-diphenylphosphido)bis{<i>trans</i>-tricarbonylbis[1-(4-ethoxybutoxy)pentylidene]rhenium}
• Authors of publication: Flörke, Ulrich; Petters, Dina
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 6
• Pages of publication: m237 - m238
• a: 10.294 ± 0.006 Å
• b: 12.102 ± 0.005 Å
• c: 12.23 ± 0.006 Å
• α: 69.86 ± 0.02°
• β: 86.58 ± 0.02°
• γ: 66.39 ± 0.02°
• Cell volume: 1305.3 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0367
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for all reflections included in the refinement: 0.0656
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes