Information card for entry 7021642

Structure parameters

• Formula: C25 H23 N4 O2 Rh
• Calculated formula: C25 H23 N4 O2 Rh
• SMILES: [Rh]1(N(N=C([N]1=Nc1c(cccc1C)C)c1ccccc1)c1c(cccc1C)C)(C#[O])C#[O]
• Title of publication: N-Aryl β-diiminate complexes of the platinum metals.
• Authors of publication: Zhu, Di; Budzelaar, Peter H. M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 32
• Pages of publication: 11343 - 11354
• a: 9.1029 ± 0.0009 Å
• b: 11.0362 ± 0.0007 Å
• c: 12.7712 ± 0.0008 Å
• α: 101.182 ± 0.005°
• β: 107.3 ± 0.005°
• γ: 97.188 ± 0.005°
• Cell volume: 1178.61 ± 0.17 ų
• Cell temperature: 208 ± 2 K
• Ambient diffraction temperature: 208 ± 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: 0.0674
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for all reflections: 0.0812
• Weighted residual factors for significantly intense reflections: 0.0757
• Weighted residual factors for all reflections included in the refinement: 0.0812
• Goodness-of-fit parameter for all reflections: 1.058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No