Information card for entry 7002940

Structure parameters

• Common name: bis(2-amino-3,5-dibromopyridinium) tetrabromocuprate
• Chemical name: bis(2-amino-3,5-dibromopyridinium) tetrabromocuprate
• Formula: C10 H10 Br8 Cu N4
• Calculated formula: C10 H10 Br8 Cu N4
• SMILES: [Cu](Br)(Br)([Br-])[Br-].[nH+]1c(N)c(cc(c1)Br)Br.[nH+]1c(N)c(cc(c1)Br)Br
• Title of publication: Transition metal complexes of 2-amino-3,5-dihalopyridines: Syntheses, structures and magnetic properties of (3,5-diCAPH)2CuX4 and (3,5-diBAPH)2CuX4
• Authors of publication: Tremelling, Grant W.; Foxman, Bruce M.; Landee, Christopher P.; Turnbull, Mark M.; Willett, Roger D.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 47
• Pages of publication: 10518 - 10526
• a: 11.587 ± 0.0011 Å
• b: 11.5942 ± 0.0011 Å
• c: 16.5555 ± 0.0015 Å
• α: 90°
• β: 107.096 ± 0.002°
• γ: 90°
• Cell volume: 2125.8 ± 0.3 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0585
• Weighted residual factors for all reflections included in the refinement: 0.0703
• Goodness-of-fit parameter for all reflections included in the refinement: 0.908
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No