Information card for entry 7004036

Structure parameters

• Formula: C24 H16 Br N3 O8 Re2
• Calculated formula: C22 H12 Br N3 O7 Re2
• Title of publication: Rhenium(i) compounds bound by tripodal ligands of pyridine and N-methylimidazole
• Authors of publication: Herrick, Richard S.; Ziegler, Christopher J.; Jameson, Donald L.; Aquina, Christopher; Çetin, Anıl; Franklin, Brenton R.; Condon, Laura R.; Barone, Natalie; Lopez, Joseph
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 27
• Pages of publication: 3605 - 3609
• a: 9.1792 ± 0.0012 Å
• b: 28.423 ± 0.004 Å
• c: 10.8379 ± 0.0014 Å
• α: 90°
• β: 92.409 ± 0.002°
• γ: 90°
• Cell volume: 2825.1 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0594
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections included in the refinement: 0.1178
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No