Information card for entry 7010799

Structure parameters

• Formula: C34 H40 N6 P2 Pd
• Calculated formula: C34 H40 N6 P2 Pd
• SMILES: [Pd]([P](C)(C)c1ccccc1)([P](C)(C)c1ccccc1)(N=C=Nc1c(cccc1C)C)c1n(nnn1)c1c(cccc1C)C
• Title of publication: Reactions of palladium(II) and platinum(II) bis(azido) complexes with isocyanides: synthesis and structural characterization of palladium(II) and platinum(II) complexes containing carbodiimido (or bis(carbodiimido)) and bis(tetrazolato) ligands
• Authors of publication: Yong-Joo Kim; Yong-Su Kwak; Young-Seon Joo; Soon-W. Lee
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 2
• Pages of publication: 144 - 151
• a: 10.0638 ± 0.001 Å
• b: 16.446 ± 0.003 Å
• c: 40.816 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6755.4 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1502
• Residual factor for significantly intense reflections: 0.0669
• Weighted residual factors for significantly intense reflections: 0.1344
• Weighted residual factors for all reflections included in the refinement: 0.1717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No