Information card for entry 7028461

Structure parameters

• Formula: C37 H34 N6 O5 Zn
• Calculated formula: C37 H34 N6 O5 Zn
• Title of publication: A new cyclic supramolecular Zn(ii) complex derived from a N2O2 oxime chelate ligand with luminescence mechanochromism.
• Authors of publication: Zhang, Shou-Ting; Li, Tian-Rong; Wang, Bao-Dui; Yang, Zheng-Yin; Liu, Jian; Wang, Zhi-Yi; Dong, Wen-Kui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 7
• Pages of publication: 2713 - 2717
• a: 10.6014 ± 0.0008 Å
• b: 10.6656 ± 0.0008 Å
• c: 15.898 ± 0.002 Å
• α: 104.972 ± 0.009°
• β: 105 ± 0.009°
• γ: 91.803 ± 0.006°
• Cell volume: 1668.1 ± 0.3 ų
• Cell temperature: 289.96 ± 0.1 K
• Ambient diffraction temperature: 289.96 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0768
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No