A Case Study in Direct-Space Structure Determination from Powder X-ray Diffraction Data: Finding the Hydrate Structure of an Organic Molecule with Significant Conformational Flexibility
Author:
Affiliation:
1. School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, Wales, and Department of Chemistry, University of Basel, Spitalstrasse 51, 4056 Basel, Switzerland
Publisher
American Chemical Society (ACS)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/cg050212d
Reference30 articles.
1. IR Spectroscopy of Pristine and Iodine-Doped Permethylpolyazine
2. Contemporary Advances in the Use of Powder X-Ray Diffraction for Structure Determination
3. How to determine structures when single crystals cannot be grown: opportunities for structure determination of molecular materials using powder diffraction data
4. Towards EXPO2005
Cited by 19 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. NMR Crystallography as a Vital Tool in Assisting Crystal Structure Determination from Powder XRD Data;Crystals;2022-09-08
2. Synchrotron Radiation Experimental Techniques;Synchrotron Radiation in Materials Science;2018-02-16
3. Optimized multi-step NMR-crystallography approach for structural characterization of a stable quercetin solvate;Journal of Pharmaceutical and Biomedical Analysis;2017-05
4. 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;Chemical Science;2017
5. Powder Diffraction;Structure from Diffraction Methods;2014-06-05
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3