Information card for entry 7011273

Structure parameters

• Formula: C44 H42 N9 O2 Rh2
• Calculated formula: C44 H42 N9 O2 Rh2
• SMILES: C([Rh]123[N](=NN(c4ccc(cc4)C)[Rh]3(C#[O])([N](=NN2c2ccc(cc2)C)c2ccc(cc2)C)[N](=NN1c1ccc(cc1)C)c1ccc(cc1)C)c1ccc(cc1)C)#[O]
• Title of publication: Novel dicarbonyl and carbonylnitrosyl tris(μ-triazenide) dirhodium complexes
• Authors of publication: Neil G. Connelly; Owen D. Hayward; Phimphaka Klangsinsirikul; A. Guy Orpen
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 3
• Pages of publication: 305 - 306
• a: 12.2254 ± 0.0019 Å
• b: 23.801 ± 0.004 Å
• c: 14.292 ± 0.003 Å
• α: 90 ± 0.009°
• β: 91.337 ± 0.015°
• γ: 90 ± 0.009°
• Cell volume: 4157.5 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0377
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0615
• Weighted residual factors for all reflections included in the refinement: 0.0655
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No