Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations: Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics

Jens Abildgaard; Simon Bolvig; Poul Erik Hansen

Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations: Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics

Jens Abildgaard, Simon Bolvig, Poul Erik Hansen

Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning

Originalsprog	Engelsk
Tidsskrift	Journal of the American Chemical Society
Vol/bind	120
Udgave nummer	35
Sider (fra-til)	9063-9069
ISSN	0002-7863
Status	Udgivet - 1998

Citer dette

Abildgaard, J., Bolvig, S., & Hansen, P. E. (1998). Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations: Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics. Journal of the American Chemical Society, 120(35), 9063-9069.

Abildgaard, Jens ; Bolvig, Simon ; Hansen, Poul Erik. / Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations : Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics. I: Journal of the American Chemical Society. 1998 ; Bind 120, Nr. 35. s. 9063-9069.

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title = "Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations: Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics",

author = "Jens Abildgaard and Simon Bolvig and Hansen, {Poul Erik}",

year = "1998",

language = "English",

volume = "120",

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Abildgaard, J, Bolvig, S & Hansen, PE 1998, 'Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations: Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics', Journal of the American Chemical Society, bind 120, nr. 35, s. 9063-9069.

Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations : Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics. / Abildgaard, Jens; Bolvig, Simon; Hansen, Poul Erik.

I: Journal of the American Chemical Society, Bind 120, Nr. 35, 1998, s. 9063-9069.

Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning

TY - JOUR

T1 - Unraveling the electronic and vibrational contributions to deuterium isotope effects on C-13 chemical shifts using ab initio model calculations

T2 - Analysis of the observed isotope effects on sterically perturbed intramolecular hydrogen-bonded o-hydroxy acyl aromatics

AU - Abildgaard, Jens

AU - Bolvig, Simon

AU - Hansen, Poul Erik

PY - 1998

Y1 - 1998

M3 - Journal article

SN - 0002-7863

VL - 120

SP - 9063

EP - 9069

JO - Journal of the American Chemical Society

JF - Journal of the American Chemical Society

IS - 35

ER -