UV Photodissociation of Pyrroles: Symmetry and Substituent Effects

Tolga N. V. Karsili; Barbara Marchetti; Roberta Moca; Michael N. R. Ashfold

doi:10.1021/jp404580v

UV Photodissociation of Pyrroles: Symmetry and Substituent Effects

Tolga N. V. Karsili, Barbara Marchetti, Roberta Moca, Michael N. R. Ashfold^*

^*Corresponding author for this work

Research output: Contribution to journal › Article (Academic Journal) › peer-review

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Abstract

H (Rydberg) atom photofragment translational spectroscopy and ab initio electronic structure calculations are used to explore ways in which ring substituents affect the photofragmentation dynamics of gas phase pyrroles. S1

Original language	English
Pages (from-to)	12067-12074
Number of pages	8
Journal	Journal of Physical Chemistry A
Volume	117
Issue number	46
Early online date	28 Jun 2013
DOIs	https://doi.org/10.1021/jp404580v
Publication status	Published - 21 Nov 2013

Keywords

NEAR-ULTRAVIOLET PHOTOLYSIS
PHOTOFRAGMENT TRANSLATIONAL SPECTROSCOPY
CONICAL INTERSECTIONS
ATOM ELIMINATION
DYNAMICS
STATES
MOLECULES
PHENOLS
ADENINE

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13 asymmetric pyrrole_final3
This document is the Accepted Manuscript version of a Published Work that appeared in final form in Journal of Physical Chemistry A, copyright © American Chemical Society after peer review and technical editing by the publisher. To access the final edited and published work see http://pubs.acs.org/page/policy/articlesonrequest/index.html
Submitted manuscript, 1.16 MB

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title = "UV Photodissociation of Pyrroles: Symmetry and Substituent Effects",

abstract = "H (Rydberg) atom photofragment translational spectroscopy and ab initio electronic structure calculations are used to explore ways in which ring substituents affect the photofragmentation dynamics of gas phase pyrroles. S1 ",

keywords = "NEAR-ULTRAVIOLET PHOTOLYSIS, PHOTOFRAGMENT TRANSLATIONAL SPECTROSCOPY, CONICAL INTERSECTIONS, ATOM ELIMINATION, DYNAMICS, STATES, MOLECULES, PHENOLS, ADENINE",

author = "Karsili, {Tolga N. V.} and Barbara Marchetti and Roberta Moca and Ashfold, {Michael N. R.}",

year = "2013",

month = nov,

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doi = "10.1021/jp404580v",

language = "English",

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journal = "Journal of Physical Chemistry A",

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T1 - UV Photodissociation of Pyrroles: Symmetry and Substituent Effects

AU - Karsili, Tolga N. V.

AU - Marchetti, Barbara

AU - Moca, Roberta

AU - Ashfold, Michael N. R.

PY - 2013/11/21

Y1 - 2013/11/21

N2 - H (Rydberg) atom photofragment translational spectroscopy and ab initio electronic structure calculations are used to explore ways in which ring substituents affect the photofragmentation dynamics of gas phase pyrroles. S1

AB - H (Rydberg) atom photofragment translational spectroscopy and ab initio electronic structure calculations are used to explore ways in which ring substituents affect the photofragmentation dynamics of gas phase pyrroles. S1

KW - NEAR-ULTRAVIOLET PHOTOLYSIS

KW - PHOTOFRAGMENT TRANSLATIONAL SPECTROSCOPY

KW - CONICAL INTERSECTIONS

KW - ATOM ELIMINATION

KW - DYNAMICS

KW - STATES

KW - MOLECULES

KW - PHENOLS

KW - ADENINE

U2 - 10.1021/jp404580v

DO - 10.1021/jp404580v

M3 - Article (Academic Journal)

C2 - 23808353

VL - 117

SP - 12067

EP - 12074

JO - Journal of Physical Chemistry A

JF - Journal of Physical Chemistry A

SN - 1089-5639

IS - 46

ER -

UV Photodissociation of Pyrroles: Symmetry and Substituent Effects

Abstract

Keywords

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