Information card for entry 2217353

Structure parameters

• Chemical name: Bis{μ-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}dinickel(II)
• Formula: C32 H28 N4 Ni2 O4
• Calculated formula: C32 H28 N4 Ni2 O4
• SMILES: [Ni]1234Oc5ccccc5C=[N]3CC[N]1=Cc1c(cccc1)[O]2[Ni]123Oc5ccccc5C=[N]3CC[N]1=Cc1c(cccc1)[O]24
• Title of publication: Bis{μ-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}dinickel(II)
• Authors of publication: Yu Ding; Zongjun Ku; Liansheng Wang; Yuanqiang Hu; Yi Zhou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: m173 - m173
• a: 26.639 ± 0.002 Å
• b: 6.9775 ± 0.0006 Å
• c: 14.7094 ± 0.0012 Å
• α: 90°
• β: 97.501 ± 0.001°
• γ: 90°
• Cell volume: 2710.7 ± 0.4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0315
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0531
• Weighted residual factors for all reflections included in the refinement: 0.0561
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes