Information card for entry 2204600

Structure parameters

• Chemical name: trans-Diaquabis[2-[3-(dimethylamino)prop-2-enoyl]pyridine]nickel(II) bis(tetrafluoroborate) dimethylformamide tetrasolvate
• Formula: C32 H56 B2 F8 N8 Ni O8
• Calculated formula: C32 H56 B2 F8 N8 Ni O8
• Title of publication: <i>trans</i>-Diaquabis{2-[3-(dimethylamino)prop-2-enoyl]pyridine}nickel(II) bis(tetrafluoroborate) dimethylformamide tetrasolvate
• Authors of publication: Ze-Qun Yan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 12
• Pages of publication: m1957 - m1958
• a: 10.036 ± 0.003 Å
• b: 10.384 ± 0.003 Å
• c: 13.384 ± 0.003 Å
• α: 107.744 ± 0.005°
• β: 93.331 ± 0.005°
• γ: 118.732 ± 0.005°
• Cell volume: 1129.4 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1322
• Residual factor for significantly intense reflections: 0.0742
• Weighted residual factors for significantly intense reflections: 0.1684
• Weighted residual factors for all reflections included in the refinement: 0.2005
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes