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Volumn 615, Issue 1-3, 2002, Pages 121-140

Deuterium isotope effects on 15N, 13C and 1H chemical shifts of proton sponges

(10) Grech, E a Klimkiewicz, J b Nowicka Scheibe, J a Pietrzak, M c Schilf, W c Pozharski, A F d Ozeryanskii, V A d Bolvig, S e Abildgaard, J f Hansen, P E f

a WEST POMERANIAN UNIVERSITY OF TECHNOLOGY (Poland)

b MEDICAL UNIVERSITY OF WARSAW (Poland)

c INSTITUTE OF ORGANIC CHEMISTRY (Poland)

d SOUTHERN FEDERAL UNIVERSITY (Russian Federation)

e LEO PHARMA A S (Denmark)

f ROSKILDE UNIVERSITY (Denmark)

Author keywords

Ab initio calculations; Equilibrium isotope effects; Geometry optimisation; Primary and secondary isotope effects on chemical shifts; Proton sponges

Indexed keywords

DEUTERIUM; HYDROGEN; ISOTOPE; NITROGEN; PROTON;

CALCULATION; CARBON NUCLEAR MAGNETIC RESONANCE; CHEMICAL STRUCTURE; CONFERENCE PAPER; EQUILIBRIUM CONSTANT; GEOMETRY; HYDROGEN BOND; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROTON NUCLEAR MAGNETIC RESONANCE; PROTON TRANSPORT; STRUCTURE ANALYSIS; X RAY ANALYSIS;

EID: 18544366221 PISSN: 00222860 EISSN: None Source Type: Journal
DOI: 10.1016/S0022-2860(02)00216-8 Document Type: Conference Paper

Times cited : (28)

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