Information card for entry 4321825

Structure parameters

• Chemical name: (mu!2$-iodo)-bis(mu!2$-pyrazolate-N,N')-bis(carbonyl-iodo-dimethyl phenylphosphine-rhodium(iii)) pentaiodide
• Formula: C24 H28 I8 N4 O2 P2 Rh2
• Calculated formula: C24 H28 I8 N4 O2 P2 Rh2
• SMILES: [Rh]12(I)([I][Rh](I)([P](c3ccccc3)(C)C)([n]3n1ccc3)([n]1n2ccc1)C#[O])([P](c1ccccc1)(C)C)C#[O].I[I-]I.II
• Title of publication: Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes
• Authors of publication: Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 1108 - 1117
• a: 11.8522 ± 0.0005 Å
• b: 13.4689 ± 0.0006 Å
• c: 25.3911 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4053.3 ± 0.3 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0856
• Weighted residual factors for all reflections included in the refinement: 0.0896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No