Information card for entry 4348803

Structure parameters

• Formula: C12 H32 Cl2 N4 O6 Zn
• Calculated formula: C12 H28 Cl2 N4 O6 Zn
• SMILES: [Zn]12(OC(=O)[C@@H]([NH2]1)CCCC[NH3+])(OC(=O)[C@@H]([NH2]2)CCCC[NH3+])Cl.[Cl-].O.O
• Title of publication: A Water-Soluble Cationic Zinc Lysine Precursor for Coating ZnO on Biomaterial Surfaces.
• Authors of publication: Yuan, Shaotang; Nawrocki, Shiri; Stranick, Michael; Yang, Ying; Zheng, Chong; Masters, James G.; Pan, Long
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 20
• Pages of publication: 10094 - 10097
• a: 5.2746 ± 0.0016 Å
• b: 17.04 ± 0.005 Å
• c: 11.407 ± 0.003 Å
• α: 90°
• β: 94.197 ± 0.005°
• γ: 90°
• Cell volume: 1022.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.034
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0816
• Weighted residual factors for all reflections included in the refinement: 0.083
• 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