Information card for entry 4074863

Structure parameters

• Formula: C40 H62 Li N O P2
• Calculated formula: C40 H62 Li N O P2
• SMILES: [P]1(C2CCCCC2)(C2CCCCC2)c2ccccc2N2c3ccccc3[P](C3CCCCC3)(C3CCCCC3)[Li]12[O](CC)CC
• Title of publication: Amido Pincer Complexes of Nickel(II): Synthesis, Structure, and Reactivity
• Authors of publication: Liang, Lan-Chang; Chien, Pin-Shu; Lin, Jia-Ming; Huang, Mei-Hui; Huang, Yu-Lun; Liao, Ju-Hsiou
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 6
• Pages of publication: 1399 - 1411
• a: 10.289 ± 0.0001 Å
• b: 10.924 ± 0.0002 Å
• c: 19.307 ± 0.0003 Å
• α: 82.516 ± 0.001°
• β: 76.763 ± 0.001°
• γ: 63.967 ± 0.001°
• Cell volume: 1896.98 ± 0.05 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0574
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No