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• W2317303725 abstract "The hydrothermal treatment of Ni(NO3)2·6H2O, NaVO3, and Bpa (1,2-Di(pyridyl)ethane) (C12H12N2) at 120 °C during 3 days leads to green single crystals of the title compound. The single crystal X-ray diffraction reveals that [{Ni3(H2O)3(Bpa)4}(V6O18)]·8H2O crystallizes in the monoclinic system, P21/c space group, with a = 13.5536 (2), b = 19.0463 (2), c = 27.7435 (3) Å, β = 112.3880 (10)°, V = 6622(3) Å3, with R1(obs) = 0.0558, wR2(obs) = 0.1359, for 10278 observed reflections. The complexity of the crystal structure is based on different points, as the existence of: both “gauche” and “trans” conformations of the organic ligand, the [V12O36]−12 cycles, formed by 12 corner-sharing VO4 tetrahedra, and, finally, the combination of both three-dimensional metal–organic and inorganic substructures, giving rise to a self-catenated highly connected net. The crystallization water molecules are semi-encapsulated in the channels along the [100] direction, and their loss gives rise to a dynamical and reversible structural contraction. Moreover, after the removal of the crystallization water molecules, the compound exhibits a negative thermal behavior in the 85–155 °C temperature range, and irreversible structural transformation due to the loss of coordinated water molecules up to 200 °C. The IR and UV–vis spectra were determined for the as-synthesized sample, after the removal of crystallization water molecules and after the irreversible transformation due to the loss of coordinated water molecules. The thermal evolution of χm was adjusted to a magnetic model considering an isotropic dimer plus two Ni(II) d8 isolated octahedra." @default.
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• W2317303725 date "2012-02-03" @default.
• W2317303725 modified "2023-10-17" @default.
• W2317303725 title "Flexible and Dynamic Thermal Behavior of Self-Catenated [{Ni3(H2O)3(Bpa)4}(V6O18)]·8H2O Constructed from 10-c Heterometallic Inorganic–Organic Clusters" @default.
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• W2317303725 doi "https://doi.org/10.1021/ic201951e" @default.
• W2317303725 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/22303905" @default.
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