Information card for entry 4326487

Structure parameters

• Common name: 07211a
• Chemical name: (N,N'-di-t-butyl-1,2-diaminoethane)-(3,5-di-t-butyl-1,2-semiquinonato) -copper(II) hexafluoroantimonate
• Formula: C28 H52 Cu F6 N2 O3 Sb
• Calculated formula: C28 H52 Cu F6 N2 O3 Sb
• Title of publication: Tale of a Twist: Magnetic and Optical Switching in Copper(II) Semiquinone Complexes
• Authors of publication: Pratik Verma; John Weir; Liviu Mirica; T. Daniel P. Stack
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 9816 - 9825
• a: 23.949 ± 0.002 Å
• b: 10.229 ± 0.001 Å
• c: 14.3115 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3505.9 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0321
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0636
• Weighted residual factors for all reflections included in the refinement: 0.0653
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No