Information card for entry 7211838

Structure parameters

• Common name: [1.5(4,4-bipy)Ni(picolinate)].DMSO.MeOH
• Formula: C25 H24 N4 Ni O6 S
• Calculated formula: C24.8 H20.4 N4 Ni O5.9 S
• Title of publication: Transition metal dipicolinates as designer T-shaped building blocks
• Authors of publication: Felloni, Marina; Blake, Alexander J.; Hubberstey, Peter; Teat, Simon J.; Wilson, Claire; Schröder, Martin
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 5
• Pages of publication: 1576
• a: 8.5299 ± 0.0005 Å
• b: 18.6015 ± 0.0011 Å
• c: 16.0248 ± 0.001 Å
• α: 90°
• β: 94.641 ± 0.002°
• γ: 90°
• Cell volume: 2534.3 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.1023
• Weighted residual factors for all reflections included in the refinement: 0.1047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No