Determination of a complex crystal structure in the absence of single crystals: analysis of powder X-ray diffraction data, guided by solid-state NMR and periodic DFT calculations, reveals a new 2′-deoxyguanosine structural motif
Author:
Affiliation:
1. School of Chemistry
2. Cardiff University
3. Cardiff
4. UK
5. Department of Physics
6. University of Warwick
7. Coventry
8. Dipartimento di Chimica “G. Ciamician”
9. Alma Mater Studiorum – Università di Bologna
10. 11-40126 Bologna
11. Italy
Abstract
A multi-technique strategy reveals a new hydrogen-bonding motif for a 2′-deoxyguanosine derivative.
Funder
Cardiff University
Engineering and Physical Sciences Research Council
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2017/SC/C7SC00587C
Reference82 articles.
1. Determination of a molecular crystal structure by X-ray powder diffraction on a conventional laboratory instrument
2. Crystal Structure Determination from Powder Diffraction Data by Monte Carlo Methods
3. Contemporary Advances in the Use of Powder X-Ray Diffraction for Structure Determination
4. Structure Determination from Powder Diffraction Data, ed. W. I. F. David, K. Shankland, L. B. McCusker and C. Baerlocher, IUCr/OUP, 2002
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