Information card for entry 7216081

Structure parameters

• Common name: ((Cu(mephenterpy))VO2(HO3PCH2CH2PO3))
• Chemical name: [{Cu(mephenterpy)}VO2(HO3PCH2CH2PO3)]
• Formula: C24 H22 Cu N3 O8 P2 V
• Calculated formula: C24 H22 Cu N3 O8 P2 V
• Title of publication: Structural consequences of the steric effects of the organoimine ligand in the oxovanadium‒organophosphonate/copper‒mephenterpy family of hybrid oxides (mephenterpy = 4′-(4-methyphenyl)-2,2′∶6′,2″-terpyridine)
• Authors of publication: Yucesan, Gundog; Yu, Min Hui; O'Connor, Charles J.; Zubieta, Jon
• Journal of publication: CrystEngComm
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 117
• Pages of publication: 711
• a: 9.2777 ± 0.0011 Å
• b: 9.9706 ± 0.0012 Å
• c: 13.3237 ± 0.0016 Å
• α: 79.104 ± 0.002°
• β: 83.541 ± 0.002°
• γ: 86.798 ± 0.002°
• Cell volume: 1201.8 ± 0.2 ų
• Cell temperature: 97 ± 2 K
• Ambient diffraction temperature: 97 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0782
• Residual factor for significantly intense reflections: 0.0649
• Weighted residual factors for significantly intense reflections: 0.1793
• Weighted residual factors for all reflections included in the refinement: 0.1872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No