15N and 13C NMR chemical shifts of 6-(fluoro, chloro, bromo, and iodo)purine 2′-deoxynucleosides: Measurements and calculations

Magnetic Resonance in Chemistry

Volumn 48, Issue 1, 2010, Pages 61-67

  Bai, Shi ^a,b   Dmitrenko, Olga ^a   Dybowski, Cecil ^a  

^a UNIVERSITY OF DELAWARE   (United States)

^b LANZHOU UNIVERSITY   (China)

Author keywords

6 halopurine nucleosides; 15N chemical shifts; DFT; GIAO; Halogen substituent

Indexed keywords

CHEMICAL SHIFT; CHLORINE COMPOUNDS;

15N CHEMICAL SHIFT; 2′-DEOXYNUCLEOSIDES; 6-HALOPURINE NUCLEOSIDE; DENSITY-FUNCTIONAL THEORY CALCULATIONS; DENSITY-FUNCTIONAL-THEORY; DEUTERATED CHLOROFORMS; GIAO; HALOGEN SUBSTITUENT; NMR CHEMICAL SHIFTS; SOLVATION EFFECT;

DENSITY FUNCTIONAL THEORY;

6 CHLOROPURINE; 6 FLUOROPURINE; 6-CHLOROPURINE; 6-FLUOROPURINE; BROMINE; CARBON; IODINE; NITROGEN; NUCLEOSIDE; PURINE DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; QUANTUM THEORY;

BROMINE; CARBON ISOTOPES; COMPUTER SIMULATION; IODINE; MAGNETIC RESONANCE SPECTROSCOPY; MOLECULAR STRUCTURE; NITROGEN ISOTOPES; NUCLEOSIDES; PURINES; QUANTUM THEORY;

EID: 73949102341     PISSN: 07491581     EISSN: 1097458X     Source Type: Journal    
DOI: 10.1002/mrc.2541     Document Type: Article

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