Information card for entry 7007937

Structure parameters

• Formula: C42.5 H55.8 Cu2 F2 N6 O24.4 P5 V4
• Calculated formula: C42.5 H45 Cu2 F2 N6 O24.4 P5 V4
• Title of publication: Solid state coordination chemistry of metal oxides: structural consequences of fluoride incorporation into the oxovanadium-copper-bisterpy-{O3P(CH2)nPO3}4- system, n= 1-5 (bisterpy = 2,2':4',4":2",2"'-quaterpyridyl-6', 6"-di-2-pyridine).
• Authors of publication: Ouellette, Wayne; Golub, Vladimir; O'Connor, Charles J; Zubieta, Jon
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 2
• Pages of publication: 291 - 309
• a: 10.7766 ± 0.0009 Å
• b: 14.1439 ± 0.0011 Å
• c: 20.1563 ± 0.0016 Å
• α: 73.173 ± 0.002°
• β: 88.644 ± 0.002°
• γ: 73.019 ± 0.002°
• Cell volume: 2806.3 ± 0.4 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0816
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1275
• Weighted residual factors for all reflections included in the refinement: 0.1411
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No