Information card for entry 2233666

Structure parameters

• Chemical name: [<i>N</i>,<i>N</i>-Bis(2-aminoethyl)ethane-1,2-diamine](ethane-1,2- diamine)nickel(II) thiosulfate trihydrate
• Formula: C8 H32 N6 Ni O6 S2
• Calculated formula: C8 H32 N6 Ni O6 S2
• Title of publication: [<i>N</i>,<i>N</i>-Bis(2-aminoethyl)ethane-1,2-diamine](ethane-1,2-diamine)nickel(II) thiosulfate trihydrate
• Authors of publication: Seidlhofer, Beatrix; Näther, Christian; Bensch, Wolfgang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 2
• Pages of publication: m167 - m168
• a: 10.89 ± 0.002 Å
• b: 10.0494 ± 0.0017 Å
• c: 16.689 ± 0.003 Å
• α: 90°
• β: 96.68 ± 0.02°
• γ: 90°
• Cell volume: 1814 ± 0.6 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 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: 0.0401
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0967
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes