Abstract
The ground- and excited-state properties of a Ni(II) porphyrin bearing peripheral alkylthio group, NiOMTP (OMTP = 2,3,7,8,12,13,17,18-octakis methylthio porphyrinate) have been investigated by steady-state and time-resolved absorption spectrometry and DFT/TDDFT theoretical methods. Several conformations corresponding to different deformations of the porphyrin core and to different orientations of the alkylthio groups have been theoretically explored. The nearly degenerate, purely ruffled D
Original language | English |
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Pages (from-to) | 6609-22 |
Journal | Inorganic Chemistry |
Volume | 44 |
Issue number | 19 |
DOIs | |
Publication status | Published - 2005 |