Information card for entry 7205841

Structure parameters

• Formula: C21 H16 N2 O4 Zn
• Calculated formula: C21 H16 N2 O4 Zn
• Title of publication: Ancillary ligand-mediated syntheses and fluorescence properties of zinc(ii) complexes based on flexible benzene dicarboxylic acid
• Authors of publication: Liu, Guang-Zhen; Xin, Ling-Yun; Wang, Li-Ya
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 8
• Pages of publication: 3013
• a: 7.66 ± 0.003 Å
• b: 10.26 ± 0.004 Å
• c: 12.88 ± 0.005 Å
• α: 110.07 ± 0.005°
• β: 93.73 ± 0.005°
• γ: 105.24 ± 0.005°
• Cell volume: 903.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0574
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1251
• Weighted residual factors for all reflections included in the refinement: 0.1337
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No