Information card for entry 7006276

Structure parameters

• Formula: C41 H52 Ni P4
• Calculated formula: C41 H52 Ni P4
• SMILES: c1(c(cc(cc1C)C)C)P1P(c2c(cc(cc2C)C)C)[Ni]1([P](C)(C)c1ccccc1)[P](C)(C)c1ccccc1.c1(ccccc1)C
• Title of publication: Oxidative cleavage of tetraaryltetraphosphane-1,4-diides by nickel(II) and palladium(II): formation of unusual Ni(0) and Pd(0) diaryldiphosphene complexes.
• Authors of publication: Gómez-Ruiz, Santiago; Hey-Hawkins, Evamarie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 48
• Pages of publication: 5678 - 5683
• a: 11.209 ± 0.003 Å
• b: 12.402 ± 0.003 Å
• c: 15.808 ± 0.003 Å
• α: 85.182 ± 0.019°
• β: 72.99 ± 0.02°
• γ: 66.42 ± 0.03°
• Cell volume: 1924.6 ± 0.9 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0739
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No