Information card for entry 7200429

Structure parameters

• Common name: tetra(pyrazole)copper(ii)(tri(pyrazole)copper(ii)) decavanadate
• Chemical name: tetra(pyrazole)copper(ii)(tri(pyrazole)copper(ii)) decavanadate
• Formula: C30 H40 Cu3 N20 O28 V10
• Calculated formula: C30 H40 Cu3 N20 O28 V10
• Title of publication: Copper pyrazole directed crystallization of decavanadates: synthesis and characterization of {Cu(pz)}4[{Cu(pz)3}2V10O28] and (Hpz)2[{Cu(pz)4}2V10O28]·2H2O
• Authors of publication: Thomas, Jency; Agarwal, Monika; Ramanan, Arunachalam; Chernova, Natasha; Whittingham, M. Stanley
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 4
• Pages of publication: 625
• a: 11.6713 ± 0.0016 Å
• b: 11.9766 ± 0.0016 Å
• c: 12.9 ± 0.0017 Å
• α: 100.226 ± 0.002°
• β: 105.549 ± 0.003°
• γ: 118.571 ± 0.002°
• Cell volume: 1422.6 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0578
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.0995
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.199
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No