A CASSCF/CASPT2 and TD-DFT Study of the Low-Lying Excited States of η5-CpMn(CO)3-Reference-Cited by-同舟云学术

A CASSCF/CASPT2 and TD-DFT Study of the Low-Lying Excited States of η5-CpMn(CO)3

Published:2000-12-12 Issue:1 Volume:105 Page:184-189
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Full Jürgen¹,González Leticia¹,Daniel Chantal¹

Affiliation:

1. Institüt für Chemie-Physikalische und Theoretische Chemie, Freie Universität Berlin, Takustrasse 3, D-14195 Berlin, Germany, and Laboratoire de Chimie Quantique, UMR 7551 CNRS/Université Louis Pasteur, Institut Le Bel, 4 Rue Blaise Pascal, 67000 Strasbourg, France

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp002042f

Reference37 articles.

1. Photochemistry of metal carbonyls

2. Photochemistry of (η-benzene)tricarbonylchromium, tricarbonyl-(η-cyclopentadienyl)manganese, and (η-cyclobutadiene)- and (tris-methylenemethane)-tricarbonyliron in frozen gas matrices at 12 K. Infrared spectroscopic evidence for dicarbonylmetal and dicarbonyl-(dinitrogen)metai complexes

3. Metal carbonyl photochemistry. Part 3. Behaviour of [Mn(η-C5H5)-(CO)3] and related species at 77 K

4. Photochemical Generation of Polymer-Bound CpMn(CO)2(.eta.2-C:C) Complexes in Polyethylene Film: A Diagnostic Probe for Investigating the Unsaturation of the Polymer

5. Femtosecond Infrared Studies of Silane Silicon−Hydrogen Bond Activation

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