Information card for entry 2201923

Structure parameters

• Chemical name: [2-[(2-hydroxydiethylammonium)aminomethylene]phenolate]zinc(II)dichloride
• Formula: C11 H16 Cl2 N2 O2 Zn
• Calculated formula: C11 H16 Cl2 N2 O2 Zn
• SMILES: [Zn]1(Cl)(Cl)Oc2ccccc2C=[N]1CC[NH2+]CCO
• Title of publication: Dichloro{2-[<i>N</i>-(2-hydroxyethylammonioethyl)iminomethyl]phenolate}zinc(II)
• Authors of publication: Anwar Usman; Hoong-Kun Fun; Suchada Chantrapromma; Hai-Liang Zhu; Qiong-Xin Liu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 2
• Pages of publication: o215 - o217
• a: 7.3217 ± 0.0004 Å
• b: 8.6557 ± 0.0004 Å
• c: 11.4876 ± 0.0006 Å
• α: 91.129 ± 0.001°
• β: 95.179 ± 0.001°
• γ: 108.674 ± 0.001°
• Cell volume: 685.97 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0232
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0572
• Weighted residual factors for all reflections included in the refinement: 0.0583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes