Information card for entry 7017303

Structure parameters

• Formula: C6 H16 N3 Ni0.5 O6 V2
• Calculated formula: C6 H16 N3 Ni0.5 O6 V2
• Title of publication: M(C(6)H(16)N(3))(2)(VO(3))(4) as heterogeneous catalysts. Study of three new hybrid vanadates of cobalt(ii), nickel(ii) and copper(ii) with 1-(2-aminoethyl)piperazonium.
• Authors of publication: Larrea, Edurne S.; Mesa, José L; Pizarro, José L; Iglesias, Marta; Rojo, Teófilo; Arriortua, María I
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 47
• Pages of publication: 12690 - 12698
• a: 9.8481 ± 0.0008 Å
• b: 9.4424 ± 0.0006 Å
• c: 14.9648 ± 0.0013 Å
• α: 90°
• β: 116.516 ± 0.006°
• γ: 90°
• Cell volume: 1245.19 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0378
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0484
• Weighted residual factors for all reflections included in the refinement: 0.0506
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No