Calculations of gas phase1H NMR chemical shifts of alcohols: An approach to optimize basis functions using factorial design

Concepts in Magnetic Resonance Part A: Bridging Education and Research

Volumn 32, Issue 3, 2008, Pages 157-167

  Tafazzoli, Mohsen ^a   Shaghaghi, Hoora ^a   Jalali Heravi, Mehdi ^a  

^a SHARIF UNIVERSITY OF TECHNOLOGY   (Iran)

Author keywords

Alcohols; Factorial design; Gas phase 1H NMR chemical shift; GIAO; ONIOM

Indexed keywords

EID: 54949127906     PISSN: 15466086     EISSN: 15525023     Source Type: Journal    
DOI: 10.1002/cmr.a.20111     Document Type: Article

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