Information card for entry 2224297

Structure parameters

• Chemical name: Diaquabis(<i>N</i>,<i>N</i>'-dibenzylethane-1,2-diamine- κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride <i>N</i>,<i>N</i>-dimethylformamide solvate
• Formula: C35 H51 Cl2 N5 Ni O3
• Calculated formula: C35 H51 Cl2 N5 Ni O3
• Title of publication: Diaquabis(<i>N</i>,<i>N</i>'-dibenzylethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride <i>N</i>,<i>N</i>-dimethylformamide solvate
• Authors of publication: Liu, Yu-Fen; Xia, Hai-Tao; Wang, Da-Qi; Gong, Xiao-Lin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1526 - m1527
• a: 11.898 ± 0.001 Å
• b: 12.588 ± 0.001 Å
• c: 14.872 ± 0.002 Å
• α: 104.769 ± 0.002°
• β: 95.368 ± 0.001°
• γ: 111.399 ± 0.002°
• Cell volume: 1961.8 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1004
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1667
• Weighted residual factors for all reflections included in the refinement: 0.201
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes