relation: http://d-scholarship-dev.library.pitt.edu/19242/
title: Density functional theory calculation of <sup>13</sup>C NMR shifts of diazaphenanthrene alkaloids: Reinvestigation of the structure of samoquasine A
creator: Timmons, C
creator: Wipf, P
description: (Chemical Equation Presented) The 13C NMR shifts of 48 diazaphenanthrene-type alkaloids have been calculated at the B3LYP/6-311+G(2d,p) level of theory. The results support the structural reassignment of samoquasine A as 2. © 2008 American Chemical Society.
date: 2008-11-21
type: Article
type: PeerReviewed
format: text/plain
language: en
rights: attached
identifier: http://d-scholarship-dev.library.pitt.edu/19242/1/licence.txt
identifier:   Timmons, C and Wipf, P  (2008) Density functional theory calculation of <sup>13</sup>C NMR shifts of diazaphenanthrene alkaloids: Reinvestigation of the structure of samoquasine A.  Journal of Organic Chemistry, 73 (22).  9168 - 9170.  ISSN 0022-3263     
relation: 10.1021/jo801735e