ABINITIO DETERMINATION OF MOLECULAR-STRUCTURES USING HIGH-RESOLUTION POWDER DIFFRACTION DATA FROM A LABORATORY X-RAY SOURCE

被引：38

作者：

LIGHTFOOT, P

GLIDEWELL, C

BRUCE, PG

机构：

来源：

JOURNAL OF MATERIALS CHEMISTRY | 1992年 / 2卷 / 03期

关键词：

POWDER DIFFRACTION; STRUCTURE SOLUTION;

D O I：

10.1039/jm9920200361

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

An ab initio determination of the structure of molecular materials using a laboratory X-ray powder diffractometer has been undertaken. Two simple molecules of unknown structure were selected specifically to demonstrate structure solution of both organometallic and organic materials by Patterson and direct methods, respectively, viz. [(C5H5)Fe(C5H4CH2NMe3)]+1- (1) and p-CH3C6H4SO2NH2 (2).

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页码：361 / 362

页数：2

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