Routine crystal structure determination from laboratory X-ray powder diffraction data.

被引：0
作者：
Xu, Xuelian [1 ]
Florence, Alastair [1 ]
Shankland, Norman [2 ]
Shankland, Kenneth [3 ]
David, William I. F. [3 ]
Kennedy, Alan R. [4 ]
机构：
[1] Univ Strathclyde, Dept Pharmaceut Sci, Glasgow G4 0NR, Lanark, Scotland
[2] CrystallografX Ltd, Glasgow, Lanark, Scotland
[3] Rutherford Appleton Lab, ISIS Facil, Didcot OX11 0QX, Oxon, England
[4] Univ Strathclyde, Dept Pure & Appl Chem, Glasgow G1 1XL, Lanark, Scotland
来源：
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES | 2004年 / 60卷
关键词：
X-ray powder diffraction; Crystal structure determination; Global optimisation;
D O I：
10.1107/S0108767304095340
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
s8.m27.p26
引用
收藏
页码：S235 / S235
页数：1
相关论文
共 50 条
  • [31] Crystal structure of CuFe2InSe4 from X-ray powder diffraction
    Delgado, G. E.
    Mora, A. J.
    Grima-Gallardo, R.
    Quintero, M.
    JOURNAL OF ALLOYS AND COMPOUNDS, 2008, 454 (1-2) : 306 - 309
  • [32] The determination of crystal structures of active pharmaceutical ingredients from X-ray powder diffraction data: a brief, practical introduction, with fexofenadine hydrochloride as example
    Bruening, Juergen
    Schmidt, Martin U.
    JOURNAL OF PHARMACY AND PHARMACOLOGY, 2015, 67 (06) : 773 - 781
  • [33] Crystal structure of the anticancer drug carmustine determined by X-ray powder diffraction
    Schlesinger, Carina
    Alig, Edith
    Schmidt, Martin U.
    POWDER DIFFRACTION, 2021, 36 (03) : 148 - 150
  • [34] Ab initio structure determination of a new compound, β-SrGaBO4, from powder X-ray diffraction data
    Yang, Z
    Liang, JK
    Chen, XL
    Chen, JR
    JOURNAL OF SOLID STATE CHEMISTRY, 2002, 165 (01) : 119 - 124
  • [35] Structure determination of enalapril maleate Form II from high-resolution X-ray powder diffraction data
    Kiang, YH
    Huq, A
    Stephens, PW
    Xu, W
    JOURNAL OF PHARMACEUTICAL SCIENCES, 2003, 92 (09) : 1844 - 1853
  • [36] Structure determination and refinement of acid strontium oxalate from X-ray and neutron powder diffraction
    Vanhoyland, G
    Bourée, F
    Van Bael, MK
    Mullens, J
    Van Poucke, LC
    JOURNAL OF SOLID STATE CHEMISTRY, 2001, 157 (02) : 283 - 288
  • [37] Multipopulation Genetic Algorithm for Simulation of the Crystal Structure from X-Ray Diffraction Data
    Zaloga, Alexander N.
    Burakov, Sergey, V
    Semenkin, Eugeniy S.
    Yakimov, Igor S.
    JOURNAL OF SIBERIAN FEDERAL UNIVERSITY-CHEMISTRY, 2014, 7 (04): : 573 - 581
  • [38] X-ray powder diffraction data for the mineral refikite
    Pazout, R.
    Sejkora, J.
    POWDER DIFFRACTION, 2012, 27 (03) : 215 - 216
  • [39] Crystal structure elucidation of anhydrous Rb2[Pt(CN)4] from X-ray powder diffraction data
    Mühle, C
    Karpov, A
    Jansen, M
    ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 2005, 60 (12): : 1269 - 1272
  • [40] X-ray powder diffraction data for trimethylene carbonate
    Pazout, R.
    Maixner, J.
    Mundil, R.
    Prokopova, I.
    POWDER DIFFRACTION, 2012, 27 (03) : 208 - 210
12345