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

P  LIGHTFOOT; C  GLIDEWELL; P G  BRUCE

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

P LIGHTFOOT, C GLIDEWELL, P G BRUCE

Research output: Contribution to journal › Comment/debate › peer-review

Abstract

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).

Original language	English
Pages (from-to)	361-362
Number of pages	2
Journal	Journal of Materials Chemistry
Volume	2
Issue number	3
Publication status	Published - Mar 1992

Keywords

POWDER DIFFRACTION
STRUCTURE SOLUTION
CRYSTAL-STRUCTURE DETERMINATION

Cite this

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

abstract = "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).",

keywords = "POWDER DIFFRACTION, STRUCTURE SOLUTION, CRYSTAL-STRUCTURE DETERMINATION",

author = "P LIGHTFOOT and C GLIDEWELL and BRUCE, {P G}",

year = "1992",

month = mar,

language = "English",

volume = "2",

pages = "361--362",

journal = "Journal of Materials Chemistry",

issn = "0959-9428",

publisher = "Royal Society of Chemistry",

number = "3",

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TY - JOUR

T1 - ABINITIO DETERMINATION OF MOLECULAR-STRUCTURES USING HIGH-RESOLUTION POWDER DIFFRACTION DATA FROM A LABORATORY X-RAY SOURCE

AU - LIGHTFOOT, P

AU - GLIDEWELL, C

AU - BRUCE, P G

PY - 1992/3

Y1 - 1992/3

N2 - 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).

AB - 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).

KW - POWDER DIFFRACTION

KW - STRUCTURE SOLUTION

KW - CRYSTAL-STRUCTURE DETERMINATION

M3 - Comment/debate

SN - 0959-9428

VL - 2

SP - 361

EP - 362

JO - Journal of Materials Chemistry

JF - Journal of Materials Chemistry

IS - 3

ER -

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

Abstract

Keywords

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