Information card for entry 4345804

Structure parameters

• Formula: C78 H56 N6 O9 Zn2
• Calculated formula: C78 H56 N6 O9 Zn2
• Title of publication: Luminescent Zn(II) Coordination Polymers for Highly Selective Sensing of Cr(III) and Cr(VI) in Water.
• Authors of publication: Gu, Tian-Yi; Dai, Ming; Young, David James; Ren, Zhi-Gang; Lang, Jian-Ping
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 8
• Pages of publication: 4669 - 4679
• a: 11.78 ± 0.006 Å
• b: 11.799 ± 0.005 Å
• c: 24.11 ± 0.011 Å
• α: 102.896 ± 0.011°
• β: 99.104 ± 0.012°
• γ: 102.543 ± 0.012°
• Cell volume: 3112 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1551
• Residual factor for significantly intense reflections: 0.1141
• Weighted residual factors for significantly intense reflections: 0.2936
• Weighted residual factors for all reflections included in the refinement: 0.3261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No