Information card for entry 2209106

Structure parameters

• Chemical name: Diiodobis(acetonitrile-N)zinc(II)
• Formula: C4 H6 I2 N2 Zn
• Calculated formula: C4 H6 I2 N2 Zn
• SMILES: C(C)#[N][Zn](I)(I)[N]#CC
• Title of publication: A redetermination of (acetonitrile-κ<i>N</i>)diiodozinc(II)
• Authors of publication: Bhosekar, Gaurav; Jeß, Inke; Näther, Christian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: m1315 - m1316
• a: 8.7049 ± 0.0007 Å
• b: 11.3913 ± 0.0011 Å
• c: 10.5121 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1042.38 ± 0.17 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 5
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0363
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0858
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes