Information card for entry 2210535

Structure parameters

• Chemical name: Tetraaqua(1,10-phenanthroline-κ^2^N,N')nickel(II) naphthalene-1,5-disulfonate dihydrate
• Formula: C22 H26 N2 Ni O12 S2
• Title of publication: Tetraaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) naphthalene-1,5-disulfonate dihydrate
• Authors of publication: Liu, Ju-Tao; Fan, Sheng-Di
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: m2507 - m2508
• a: 20.562 ± 0.003 Å
• b: 12.4311 ± 0.0019 Å
• c: 12.5373 ± 0.0018 Å
• α: 90°
• β: 124.576 ± 0.002°
• γ: 90°
• Cell volume: 2638.6 ± 0.7 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• 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: 0.0484
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0891
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: Yes