Information card for entry 2011276

Structure parameters

• Common name: Bis[3-(o-methoxyphenyl)-1-methyltriazene 1-oxide(1-)-O,N^3^,O']zinc(II)
• Chemical name: Bis[3-(o-methoxyphenyl)-1-methyltriazene 1-oxide(1-)-O,N^3^,O']zinc(II)
• Formula: C16 H20 N6 O4 Zn
• Calculated formula: C16 H20 N6 O4 Zn
• SMILES: [Zn]12([O]=N(=NN1c1c(OC)cccc1)C)[O]=N(=NN2c1c(OC)cccc1)C
• Title of publication: Bis[3-(<i>o</i>-methoxyphenyl)-1-methyltriazene 1-oxidato-<i>O</i>,<i>N</i>^3^,<i>O</i>']zinc(II)
• Authors of publication: Mukherjee, Alok K.; Samanta, Chitra; Mukherjee, Monika; Helliwell, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 8
• Pages of publication: 952 - 954
• a: 10.853 ± 0.001 Å
• b: 11.547 ± 0.001 Å
• c: 7.821 ± 0.001 Å
• α: 96.97 ± 0.01°
• β: 110.03 ± 0.01°
• γ: 86.84 ± 0.01°
• Cell volume: 913.94 ± 0.18 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: 0.048
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 0.966
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes