Information card for entry 7000106

Structure parameters

• Formula: C58.5 H53 Br4 Cl9 N2 Ni2 P4
• Calculated formula: C58.5 H53 Br4 Cl9 N2 Ni2 P4
• Title of publication: Oligodentate P,N ligands: N,N,N',N'-tetrakis(diphenylphosphanyl)-1,3-diaminobenzene complexes of rhodium, nickel and palladium.
• Authors of publication: Majoumo-Mbe, Félicité; Lönnecke, Peter; Novikova, Elena V.; Belov, Gennadiy P.; Hey-Hawkins, Evamarie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 20
• Pages of publication: 3326 - 3330
• a: 15.488 ± 0.002 Å
• b: 15.488 ± 0.002 Å
• c: 58.128 ± 0.011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13944 ± 4 ų
• Cell temperature: 208 ± 2 K
• Ambient diffraction temperature: 208 ± 2 K
• Number of distinct elements: 7
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.1541
• Residual factor for significantly intense reflections: 0.1071
• Weighted residual factors for significantly intense reflections: 0.2411
• Weighted residual factors for all reflections included in the refinement: 0.2641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No