Information card for entry 7026283

Structure parameters

• Formula: C21 H30 N P Zn
• Calculated formula: C21 H30 N P Zn
• SMILES: [Zn]1([P](C(C)C)(c2c(N1c1c(cccc1C)C)cccc2)C(C)C)C
• Title of publication: Amido phosphine complexes of zinc: synthesis, structure, and catalytic ring-opening polymerization of epsilon-caprolactone.
• Authors of publication: Liang, Lan-Chang; Lee, Wei-Ying; Tsai, Tzung-Ling; Hsu, Yu-Lin; Lee, Ting-Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 37
• Pages of publication: 8748 - 8758
• a: 14.6479 ± 0.0005 Å
• b: 8.9972 ± 0.0003 Å
• c: 15.6842 ± 0.0006 Å
• α: 90°
• β: 94.579 ± 0.002°
• γ: 90°
• Cell volume: 2060.42 ± 0.13 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0713
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1508
• Weighted residual factors for all reflections included in the refinement: 0.1725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No