Information card for entry 4323938

Structure parameters

• Common name: [Et4N][Fe((DMG)BF2)2Cl2]
• Chemical name: tetraethylammoniumdichlorobis(dimethylglyoximato(difluoroborato)ferate
• Formula: C16 H32 B2 Cl2 F4 Fe N5 O4
• Calculated formula: C16 H28 B2 Cl2 F4 Fe N5 O4
• Title of publication: Stereochemistry of Boron-Functionalized (Dioximato)iron(II) Complexes. Control of Nonbonded Interactions on Soft Conformational Surfaces
• Authors of publication: Isak Vernik; Dennis V. Stynes
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 6210 - 6220
• a: 7.811 ± 0.002 Å
• b: 8.045 ± 0.002 Å
• c: 11.748 ± 0.002 Å
• α: 76.53 ± 0.03°
• β: 73.1 ± 0.03°
• γ: 63.04 ± 0.03°
• Cell volume: 625.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0499
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for all reflections: 0.125
• Weighted residual factors for significantly intense reflections: 0.1196
• Goodness-of-fit parameter for all reflections: 1.085
• Goodness-of-fit parameter for significantly intense reflections: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No