Information card for entry 7047587

Structure parameters

• Formula: C48 H66 Cl2 O12 P2 Re2
• Calculated formula: C48 H66 Cl2 O12 P2 Re2
• Title of publication: Phosphine oxide-based tricarbonylrhenium(i) complexes from phosphine/phosphine oxide and dihydroxybenzoquinones.
• Authors of publication: Arumugam, Ramar; Shankar, Bhaskaran; Shanmugam, Ramasamy; Arumuganathan, T.; Sathiyendiran, Malaichamy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 39
• Pages of publication: 13894 - 13901
• a: 9.381 ± 0.002 Å
• b: 15.843 ± 0.004 Å
• c: 17.889 ± 0.004 Å
• α: 95.666 ± 0.007°
• β: 104.06 ± 0.009°
• γ: 98.898 ± 0.009°
• Cell volume: 2522.1 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2105
• Residual factor for significantly intense reflections: 0.1546
• Weighted residual factors for significantly intense reflections: 0.3658
• Weighted residual factors for all reflections included in the refinement: 0.4019
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No