Information card for entry 7703884

Structure parameters

• Formula: C81 H105 Cl Li N6 O6 Rh3
• Calculated formula: C81 H105 Cl Li N6 O6 Rh3
• SMILES: [Rh]123456[Rh]789%10([Rh]%111([Cl]28)([N](c1c(C(C)C)cccc1C(C)C)=CN(C%11=[O][Li]([O]=C7N(C=[N]9c1c(C(C)C)cccc1C(C)C)c1c(cccc1C(C)C)C(C)C)[O]=C6N(c1c(cccc1C(C)C)C(C)C)C=[N]3c1c(cccc1C(C)C)C(C)C)c1c(C(C)C)cccc1C(C)C)(C%10=O)C4=O)C5=O
• Title of publication: Bulky bis(aryl)triazenides: just aspiring amidinates? A structural and spectroscopic study.
• Authors of publication: Gyton, Matthew R.; Leverett, Anthony R.; Cole, Marcus L.; McKay, Alasdair I.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 17
• Pages of publication: 5653 - 5661
• a: 34.876 ± 0.003 Å
• b: 26.438 ± 0.003 Å
• c: 22.979 ± 0.002 Å
• α: 90°
• β: 115.098 ± 0.005°
• γ: 90°
• Cell volume: 19187 ± 3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• 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: 0.0931
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1656
• Weighted residual factors for all reflections included in the refinement: 0.1918
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No