Information card for entry 4318479

Structure parameters

• Common name: ZnCl2(NOHC(CH3)2)2
• Formula: C6 H14 Cl2 N2 O2 Zn
• Calculated formula: C6 H14 Cl2 N2 O2 Zn
• SMILES: C(C)(C)=[N](O)[Zn]([N](=C(C)C)O)(Cl)Cl
• Title of publication: Zinc(II)/Ketoxime System as a Simple and Efficient Catalyst for Hydrolysis of Organonitriles
• Authors of publication: Maximilian N. Kopylovich; Vadim Yu. Kukushkin; Matti Haukka; João J. R. Fraústo da Silva; Armando J. L. Pombeiro
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4798 - 4804
• a: 7.1096 ± 0.0001 Å
• b: 8.8985 ± 0.0002 Å
• c: 10.9267 ± 0.0003 Å
• α: 88.086 ± 0.001°
• β: 71.811 ± 0.001°
• γ: 67.061 ± 0.001°
• Cell volume: 601.71 ± 0.02 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0425
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.1087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No