Information card for entry 7016263

Structure parameters

• Formula: C24 H18 N4 O10 Re2
• Calculated formula: C24 H18 N4 O10 Re2
• SMILES: c1ccc[n]2c1C=[N]1[C@@H](C)C(=O)O[Re]3(C#[O])(C#[O])(C#[O])[n]4c(C=[N]3[C@H](C(=O)O[Re]21(C#[O])(C#[O])C#[O])C)cccc4
• Title of publication: Synthesis of dimeric Re(I) amino acid conjugate complexes.
• Authors of publication: Qayyum, Hira; Herrick, Richard S.; Ziegler, Christopher J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 28
• Pages of publication: 7442 - 7445
• a: 9.859 ± 0.003 Å
• b: 15.088 ± 0.005 Å
• c: 17.416 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2590.7 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1091
• Goodness-of-fit parameter for all reflections included in the refinement: 0.911
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No