Information card for entry 7026253

Structure parameters

• Chemical name: Bis(2,2':6',2''-terpyridine)cobalt(II) ditetrafluoroborate
• Formula: C30 H22 B2 Co F8 N6
• Calculated formula: C30 H22 B2 Co F8 N6
• Title of publication: An unusual discontinuity in the thermal spin transition in [Co(terpy)2][BF4]2.
• Authors of publication: Kilner, Colin A.; Halcrow, Malcolm A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 38
• Pages of publication: 9008 - 9012
• a: 12.6234 ± 0.0012 Å
• b: 12.4686 ± 0.0012 Å
• c: 19.5075 ± 0.0019 Å
• α: 90°
• β: 96.558 ± 0.005°
• γ: 90°
• Cell volume: 3050.3 ± 0.5 ų
• Cell temperature: 325 ± 2 K
• Ambient diffraction temperature: 325 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0501
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1223
• Weighted residual factors for all reflections included in the refinement: 0.1284
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No