Information card for entry 7006830

Structure parameters

• Formula: C33 H33 N6 O2 Pd Rh
• Calculated formula: C33 H33 N6 O2 Pd Rh
• SMILES: [Rh](N(N=[N](c1ccc(cc1)C)[Pd]123[CH2]=[CH]3C1)c1ccc(cc1)C)(N(N=[N]2c1ccc(cc1)C)c1ccc(cc1)C)(C#[O])C#[O]
• Title of publication: Triazenide-bridged rhodium-palladium complexes: [I2Rh(mu-p-MeC6H4NNNC6H4Me-p)2Pd(eta(3)-C3H5)]-, a stable paramagnetic [RhPd]4+ species with a localised Rh(II) centre.
• Authors of publication: Adams, Christopher J.; Baber, R. Angharad; Connelly, Neil G.; Harding, Phimphaka; Hayward, Owen D.; Kandiah, Mathivathani; Orpen, A. Guy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 14
• Pages of publication: 1749 - 1757
• a: 17.962 ± 0.003 Å
• b: 8.9123 ± 0.001 Å
• c: 26.282 ± 0.006 Å
• α: 90°
• β: 129.608 ± 0.013°
• γ: 90°
• Cell volume: 3241.4 ± 1.2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.035
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No