Information card for entry 7715694

Structure parameters

• Formula: C38 H74 Cl6 N2 O6 Re2
• Calculated formula: C38 H74 Cl6 N2 O6 Re2
• Title of publication: Electrochemical water oxidation reaction by dinuclear Re(V) oxo complexes with a 1,4-benzoquinone core <i>via</i> the redox induced electron transfer (RIET) process.
• Authors of publication: Shee, Uday; Sinha, Debopam; Mondal, Sandip; Rajak, Kajal Krishna
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 8254 - 8263
• a: 10.488 ± 0.003 Å
• b: 13.127 ± 0.013 Å
• c: 17.843 ± 0.006 Å
• α: 90°
• β: 91.283 ± 0.018°
• γ: 90°
• Cell volume: 2456 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0718
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0781
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No