Information card for entry 2221712

Structure parameters

• Chemical name: [μ-<i>N</i>,<i>N</i>,<i>N',<i>N</i>'-Tetrakis(diphenylphosphinomethyl)benzene- 1,4-diamine-κ^4^<i>P/i>,<i>P/i>':<i>P/i>'',<i>P/i>''']bis[bis(nitrato- κO)palladium(II)]
• Formula: C58 H52 N6 O12 P4 Pd2
• Calculated formula: C58 H52 N6 O12 P4 Pd2
• SMILES: c1(N2C[P](c3ccccc3)(c3ccccc3)[Pd](ON(=O)=O)(ON(=O)=O)[P](C2)(c2ccccc2)c2ccccc2)ccc(cc1)N1C[P](c2ccccc2)(c2ccccc2)[Pd](ON(=O)=O)(ON(=O)=O)[P](C1)(c1ccccc1)c1ccccc1
• Title of publication: [μ-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(diphenylphosphinomethyl)benzene-1,4-diamine-κ^4^<i>P</i>,<i>P</i>':<i>P</i>'',<i>P</i>''']bis[bis(nitrato-κ<i>O</i>)palladium(II)]
• Authors of publication: Jiang, Xuan-Feng; Lian, Heng-Chi; Min, Zhong; Wang, Xiu-Jian; Lin, Jia-Huang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m597 - m598
• a: 8.0715 ± 0.0002 Å
• b: 21.3419 ± 0.0007 Å
• c: 16.0283 ± 0.0005 Å
• α: 90°
• β: 92.937 ± 0.003°
• γ: 90°
• Cell volume: 2757.43 ± 0.14 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0805
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0666
• Weighted residual factors for all reflections included in the refinement: 0.0723
• Goodness-of-fit parameter for all reflections included in the refinement: 0.796
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes