Information card for entry 2212096

Structure parameters

• Chemical name: trans-Diaquabis(N,N'-dimethylethane-1,2-diamine-κ^2^N,N')nickel(II) dichloride dihydrate
• Formula: C8 H32 Cl2 N4 Ni O4
• Calculated formula: C8 H32 Cl2 N4 Ni O4
• Title of publication: <i>trans</i>-Diaquabis(<i>N</i>,<i>N</i>-dimethylethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride dihydrate: a redetermination at 90 K
• Authors of publication: Daniela M. M. Ide; Richard E. Norman
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: m558 - m560
• a: 7.4277 ± 0.001 Å
• b: 13.003 ± 0.002 Å
• c: 9.548 ± 0.002 Å
• α: 90°
• β: 107.787 ± 0.007°
• γ: 90°
• Cell volume: 878.1 ± 0.3 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for all reflections: 0.0975
• Weighted residual factors for all reflections included in the refinement: 0.0906
• Goodness-of-fit parameter for all reflections: 1.026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0467
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes