Information card for entry 7022108

Structure parameters

• Common name: Bis(2,6-bis(pyrid-2-yl)pyrazine)iron(ii) ditetrafluoroborate nitromethane solvate
• Chemical name: Bis(2,6-bis(pyrid-2-yl)pyrazine]iron(II) ditetrafluoroborate nitromethane solvate
• Formula: C29 H23 B2 F8 Fe N9 O2
• Calculated formula: C29 H23 B2 F8 Fe N9 O2
• Title of publication: Iron(II) and cobalt(II) complexes of tris-azinyl analogues of 2,2':6',2''-terpyridine.
• Authors of publication: Cook, Laurence J Kershaw; Tuna, Floriana; Halcrow, Malcolm A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 6
• Pages of publication: 2254 - 2265
• a: 8.8102 ± 0.0004 Å
• b: 8.8297 ± 0.0004 Å
• c: 39.8492 ± 0.0018 Å
• α: 90°
• β: 90.181 ± 0.002°
• γ: 90°
• Cell volume: 3099.9 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0774
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for significantly intense reflections: 0.168
• Weighted residual factors for all reflections included in the refinement: 0.1713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No