Information card for entry 1562784

Structure parameters

• Formula: C7 H15 N O10 Zn
• Calculated formula: C7 H15 N O10 Zn
• SMILES: [Zn]1([n]2cc(ccc2C(=O)O1)C(=O)[O-])([OH2])([OH2])([OH2])[OH2].O.O
• Title of publication: Syntheses, structures and photoelectric properties of a series of Cd(II)/Zn(II) coordination polymers and coordination supramolecules
• Authors of publication: Jin, Jing; Han, Xiao; Meng, Qin; Li, Dan; Chi, Yu-Xian; Niu, Shu-Yun
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2013
• Journal volume: 197
• Pages of publication: 92 - 102
• a: 7.0857 ± 0.0014 Å
• b: 8.3323 ± 0.0017 Å
• c: 11.449 ± 0.002 Å
• α: 107.14 ± 0.03°
• β: 99.42 ± 0.03°
• γ: 102.75 ± 0.03°
• Cell volume: 610.7 ± 0.3 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: 0.0265
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.0551
• Weighted residual factors for all reflections included in the refinement: 0.0568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No