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Angewandte Chemie International Edition, ISSN 1433-7851, 02/2016, Volume 55, Issue 8, pp. 2748 - 2752
Journal Article
European Journal of Inorganic Chemistry, ISSN 1434-1948, 08/2005, Volume 2005, Issue 15, pp. 2957 - 2971
Journal Article
Coordination Chemistry Reviews, ISSN 0010-8545, 11/2018, Volume 375, pp. 256 - 266
Electronically labile, or switchable, cobalt coordination polymers exhibit reversible spin crossover (SCO) or valence tautomeric (VT) transitions upon the... 
Valence tautomerism | Coordination polymers | Redox isomerism | Metal organic frameworks | Cobalt | Spin crossover | DESIGN | CRYSTAL-STRUCTURE | BEHAVIOR | GUEST | STATE | MOFS | CHEMISTRY, INORGANIC & NUCLEAR | TRANSITION | PRESSURE | METAL-COMPLEXES | Polymers | Polymer industry
Journal Article
Coordination Chemistry Reviews, ISSN 0010-8545, 06/2014, Volume 268, pp. 23 - 40
Valence tautomeric (VT) transitions involve stimulated intramolecular electron transfer between a redox-active metal center and a redox-active organic ligand;... 
Valence tautomerism | Spin crossover | Switchable molecules | Electron transfer | Redox isomerism | Non-innocent ligands | Dioxolene complexes | SPIN-CROSSOVER | X-RAY-ABSORPTION | CRYSTAL-STRUCTURES | THERMAL HYSTERESIS | CHEMISTRY, INORGANIC & NUCLEAR | MIXED-VALENCE | QUINONE COMPLEXES | CHARGE-DISTRIBUTION | PHASE-TRANSITION | MAGNETIC-PROPERTIES | Electron transport
Journal Article
European Journal of Inorganic Chemistry, ISSN 1434-1948, 01/2017, Volume 2017, Issue 2, pp. 401 - 411
Journal Article
DALTON TRANSACTIONS, ISSN 1477-9226, 02/2019, Volume 48, Issue 5, pp. 1795 - 1813
Using a potentially tridentate o-aminophenol-based redox-active ligand H2L1 (2-[2-(benzylthio) phenylamino]- 4,6-di-tert-butylphenol) in its deprotonated form,... 
COPPER(II) COMPLEXES | NON-INNOCENT LIGANDS | TRANSITION-METAL-COMPLEXES | INTRAMOLECULAR ELECTRON-TRANSFER | IMINOBENZOSEMIQUINONATO COMPLEXES | CHARGE-DISTRIBUTION | OXIDATION-STATES | REDOX-ACTIVE LIGANDS | TRIPLE ZETA VALENCE | GAUSSIAN-BASIS SETS | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Journal of Physical Organic Chemistry, ISSN 0894-3230, 08/2013, Volume 26, Issue 8, pp. 643 - 652
The performance of several functionals (M06‐2X, B97D, ωB97 family and B2PLYPD), accounting long range correlation, was evaluated in respect of the tautomerism... 
tautomeric equilibrium | DFT | azonaphthols | model tautomers | quantum‐chemical calculations | quantum-chemical calculations | DISPERSION CORRECTIONS | AZO DYES | STATES | CHEMISTRY, ORGANIC | CHEMISTRY, PHYSICAL | HYBRID DENSITY FUNCTIONALS | MOLECULES | ZETA VALENCE QUALITY | SCHIFF-BASES | M06 SUITE | BASIS-SETS | ENERGIES
Journal Article
Organometallics, ISSN 0276-7333, 10/2013, Volume 32, Issue 19, pp. 5360 - 5373
The reactions of K[HC(PPh2NSiMe3)(2)] (K[1]) and MI3 (M = As, Sb) or TeI4 gave as the major products the complexes [{MIn}{C(PPh2NSiMe3)(PPh2NHSiMe3)}] (MIn =... 
ELECTRON-GAS | REGULAR 2-COMPONENT HAMILTONIANS | ALKALI-METAL LI | TRANSITION-STATE METHOD | CRYSTAL-STRUCTURE | 2ND DERIVATIVES | COMPLEXES | X-RAY | CORRELATION-ENERGY | CHEMISTRY, ORGANIC | 2-ELECTRON VALENCE INDEXES | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Tetrahedron, ISSN 0040-4020, 09/2018, Volume 74, Issue 37, pp. 4791 - 4798
The tautomerism of protonated imidazoles concerns one aromatic (1H-Imi+) and one nonaromatic (4H-Imi+) tautomers. Both experiments and computations have shown... 
Protonated imidazole | Valence bond (VB) | Tautomerism | Resonance | Block-localized wavefunction (BLW) | CHEMISTRY, ORGANIC | AROMATIC CHARACTER | IMINE-ENAMINE TAUTOMERISM | PI-ELECTRON DELOCALIZATION | GAS-PHASE | SYSTEMS | DENSITY-FUNCTIONAL THEORY | THEORETICAL-ANALYSIS | INDEPENDENT CHEMICAL-SHIFTS | REDOX FORMS | WATER | Hydrogen | Hydrogen bonding | Analysis
Journal Article