Information card for entry 7010198

Structure parameters

• Formula: C18 H26 Cl2 N6 O12 Os
• Calculated formula: C18 H26 Cl2 N6 O12 Os
• SMILES: C12C=CC=CC2=[NH][Os]23([NH]=1)([NH]=C1C=CC=CC1=[NH2]2)[NH2]=C1C=CC=CC1=[NH]3.Cl(=O)(=O)(=O)[O-].O.O.Cl(=O)(=O)(=O)[O-].O.O
• Title of publication: Synthesis and structure of tris(1,2-benzoquinone diimine)osmium(II) perchlorate, and its redox and spectroelectrochemical series ‡
• Authors of publication: Ghosh, Amit K.; Peng, Shie-Ming; Paul, Rowena L.; Ward, Michael D.; Goswami, Sreebrata
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 3
• Pages of publication: 336
• a: 18.56 ± 0.0001 Å
• b: 9.3076 ± 0.0001 Å
• c: 15.9116 ± 0.0002 Å
• α: 90°
• β: 100.416 ± 0.001°
• γ: 90°
• Cell volume: 2703.42 ± 0.05 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for all reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.0626
• Goodness-of-fit parameter for all reflections: 1.053
• Goodness-of-fit parameter for significantly intense reflections: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No