Structure of the Photodissociation Products of CCl4, CBr4, and CI4 in Solution Studied by DFT and ab Initio Calculations-Reference-Cited by-同舟云学术

Structure of the Photodissociation Products of CCl4, CBr4, and CI4 in Solution Studied by DFT and ab Initio Calculations

Published:2006-09-01 Issue:38 Volume:110 Page:11178-11187
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Kong Qingyu¹,Wulff Michael¹,Bratos Savo¹,Vuilleumier Rodolphe¹,Kim Joonghan¹,Ihee Hyotcherl¹

Affiliation:

1. European Synchrotron Radiation Facility, Grenoble Cedex 38043, BP 220, France, Laboratoire de Physique, Théorique des Liquides, Université Pierre et Marie Curie, Case Courrier 121, 4 Place Jussieu, Paris Cedex 75252, France, and Department of Chemistry and School of Molecular Science (BK21), Korea Advanced Institute of Science and Technology (KAIST), Daejeon, 305-701, Republic of Korea

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp062919w

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4. The singlet–triplet gap of the halonitrenium ions NHX+, NX2+and the halocarbenes CHX, CX2(X = F, Cl, Br, I)

5. Singlet-triplet gaps in substituted carbenes CXY (X, Y = H, fluoro, chloro, bromo, iodo, silyl)

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