Information card for entry 2219714

Structure parameters

• Chemical name: Dibromidobis[2-(dicyclohexylphosphanyl)biphenyl-κP]palladium(II)
• Formula: C48 H62 Br2 P2 Pd
• Calculated formula: C48 H62 Br2 P2 Pd
• SMILES: C1CCC(CC1)[P]([Pd]([P](C1CCCCC1)(C1CCCCC1)c1c(c2ccccc2)cccc1)(Br)Br)(C1CCCCC1)c1c(c2ccccc2)cccc1
• Title of publication: Dibromidobis[2-(dicyclohexylphosphanyl)biphenyl-κ<i>P</i>]palladium(II)
• Authors of publication: Xu, Chen; Li, Ying-Fei; Wang, Zhi-Qiang; Cen, Fei-Fei; Zhang, Yu-Qing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: m1349
• a: 9.817 ± 0.008 Å
• b: 9.827 ± 0.008 Å
• c: 11.957 ± 0.01 Å
• α: 91.582 ± 0.011°
• β: 108.822 ± 0.01°
• γ: 103.713 ± 0.01°
• Cell volume: 1053.9 ± 1.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0946
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1637
• Weighted residual factors for all reflections included in the refinement: 0.1799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes