%0 Journal Article %1 Grupp.2014b %A Grupp, Anita %A Bubrin, Martina %A Ehret, Fabian %A Kvapilova, Hana %A Zalis, Stanislav %A Kaim, Wolfgang. %D 2014 %J Journal of Organometallic Chemistry %K DFT carbonyl charge complex crystal diazabutadiene diimine halide oxidn prepn pseudohalide redn rhenium spectroelectrochem structure transfer;rhenium %P 678--685 %R 10.1016/j.jorganchem.2013.08.030 %T Oxidation and reduction response of a-diimine complexes with tricarbonylrhenium halides and pseudohalides %V 751 %X Compds. Re(CO)3X(R-DAB), X = Cl, Br, CN, NCS and R-DAB = RN=CH-CH=NR (R = tert-butyl) were obtained, structurally characterized, and studied with regard to their oxidn. and redn. behavior using cyclic voltammetry, EPR, IR and UV-visible-NIR spectroelectrochem. Whereas the halide compds. exhibit more reversible oxidn. processes, the pseudohalide complexes display reversible one-electron redn., but irreversible oxidn. DFT and TD-DFT calcns. were employed to confirm the exptl. derived electronic structures and spectral properties. on SciFinder(R)

@article{Grupp.2014b, abstract = {Compds. [Re(CO)3X(R-DAB)], X = Cl, Br, CN, NCS and R-DAB = RN=CH-CH=NR (R = tert-butyl) were obtained, structurally characterized, and studied with regard to their oxidn. and redn. behavior using cyclic voltammetry, EPR, IR and UV-visible-NIR spectroelectrochem. Whereas the halide compds. exhibit more reversible oxidn. processes, the pseudohalide complexes display reversible one-electron redn., but irreversible oxidn. DFT and TD-DFT calcns. were employed to confirm the exptl. derived electronic structures and spectral properties. [on SciFinder(R)]}, added-at = {2022-06-15T11:26:56.000+0200}, author = {Grupp, Anita and Bubrin, Martina and Ehret, Fabian and Kvapilova, Hana and Zalis, Stanislav and Kaim, Wolfgang.}, biburl = {https://puma.ub.uni-stuttgart.de/bibtex/29c53c19f86a5da69772d6c7937e56d24/huebleriac}, doi = {10.1016/j.jorganchem.2013.08.030}, interhash = {350f4aa82b2134b371b77d2907d2f55a}, intrahash = {9c53c19f86a5da69772d6c7937e56d24}, journal = {Journal of Organometallic Chemistry}, keywords = {DFT carbonyl charge complex crystal diazabutadiene diimine halide oxidn prepn pseudohalide redn rhenium spectroelectrochem structure transfer;rhenium}, pages = {678--685}, timestamp = {2022-06-15T09:26:56.000+0200}, title = {Oxidation and reduction response of \textgreek{a}-diimine complexes with tricarbonylrhenium halides and pseudohalides}, volume = 751, year = 2014 }