Information card for entry 7714089

Structure parameters

• Chemical name: Bis[2,6-Bis(imidazo[1,2-a]pyridin-2-yl)pyridine]iron(II)tetrafluoroborate (2/1.6) hexafluorosilicate (1/0.2) nitromethane/diethyl ether solvate
• Formula: C40.9 H34.1 B1.6 F7.6 Fe N11.7 O3.7 Si0.2
• Calculated formula: C40.9 H34.1 B1.6 F7.6 Fe N11.7 O3.7 Si0.2
• Title of publication: Iron(II) Complexes of 2,6-Bis(imidazo[1,2‑a]pyridin-2-yl)pyridine and Related Ligands with Annelated Distal Heterocyclic Donors
• Authors of publication: Kulmaczewski, Rafal; Halcrow, Malcolm
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 12.752 ± 0.0004 Å
• b: 13.6771 ± 0.0004 Å
• c: 13.9688 ± 0.0004 Å
• α: 79.861 ± 0.002°
• β: 78.387 ± 0.003°
• γ: 64.173 ± 0.003°
• Cell volume: 2137.25 ± 0.12 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0764
• Residual factor for significantly intense reflections: 0.0705
• Weighted residual factors for significantly intense reflections: 0.1912
• Weighted residual factors for all reflections included in the refinement: 0.1999
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No