Information card for entry 7016158

Structure parameters

• Formula: C36 H32 N4 O12 Rh2
• Calculated formula: C36 H32 N4 O12 Rh2
• SMILES: c1c(c2c([n]([Rh]3456[O]=C(C)O[Rh]6([n]6cccc7c(c[nH]c67)c6cccc(c6)C(=O)O)([O]=C(O4)C)(OC(=[O]3)C)[O]=C(O5)C)ccc2)[nH]1)c1cccc(c1)C(=O)O
• Title of publication: From insertion of rhodium acetate paddlewheels into functionalized 7-azaindole hydrogen-bonded dimers to infinite architectures.
• Authors of publication: Pogozhev, Dmitry; Baudron, Stéphane A; Hosseini, Mir Wais
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 28
• Pages of publication: 7403 - 7411
• a: 7.7872 ± 0.0002 Å
• b: 11.7497 ± 0.0003 Å
• c: 13.7757 ± 0.0004 Å
• α: 110.514 ± 0.001°
• β: 96.115 ± 0.001°
• γ: 96.072 ± 0.001°
• Cell volume: 1159.85 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0393
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0904
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No