Information card for entry 4075987

Structure parameters

• Formula: C92 H112 N4 O2 P4 Zn2
• Calculated formula: C92 H112 N4 O2 P4 Zn2
• SMILES: [Zn]12N([P]([Zn]3N([P]1(c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)c1c(N3[P](c3c(cc(cc3C)C)C)c3c(cc(cc3C)C)C)cccc1)(c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)c1c(N2[P](c2c(cc(cc2C)C)C)c2c(cc(cc2C)C)C)cccc1.O1CCCC1.O1CCCC1
• Title of publication: Zwitterionic and Bis-amido Zinc Complexes with Bulky Bis(phosphanylamino)benzene Ligands: Synthesis, Reactivity, and Molecular Structures of [ZnCl2(1,2-{N(PHMes2)}2C6H4-κ2N,N‘)], [ZnPr{1-N(PMes2)-2-N(PHMes2)C6H4-κ2N,N‘}], and [Zn{1-N(PMes2)-2-N(μ-PMes2)C6H4-κ3N,N‘,P}]2
• Authors of publication: Majoumo-Mbe, Félicité; Lönnecke, Peter; Hey-Hawkins, Evamarie
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 22
• Pages of publication: 5287
• a: 14.835 ± 0.005 Å
• b: 16.757 ± 0.006 Å
• c: 18.924 ± 0.007 Å
• α: 73.296 ± 0.007°
• β: 80.234 ± 0.006°
• γ: 76.048 ± 0.007°
• Cell volume: 4347 ± 3 ų
• Cell temperature: 217 ± 2 K
• Ambient diffraction temperature: 217 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1923
• Residual factor for significantly intense reflections: 0.0712
• Weighted residual factors for significantly intense reflections: 0.2137
• Weighted residual factors for all reflections included in the refinement: 0.2595
• Goodness-of-fit parameter for all reflections included in the refinement: 0.89
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No