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Structure and order of the discotic compound 2,3,6,7,10,11-hexakispentyloxytriphenylene...
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Structure and order of the discotic compound 2,3,6,7,10,11-hexakispentyloxytriphenylene as revealed by diffraction and molecular simulation studies
作者:
TAO WANG,
DONGHANG YAN,
JUN LUO,
ENLE ZHOU,
O. KARTHAUS,
H. RINGSDORF,
期刊:
Liquid Crystals
(Taylor Available online 1997)
卷期:
Volume 23,
issue 6
页码: 869-878
ISSN:0267-8292
年代: 1997
DOI:10.1080/026782997207795
出版商: Taylor & Francis Group
数据来源: Taylor
摘要:
The aggregate structure of the discotic compound 2,3,6,7,10,11-hexakispentyloxytriphenylene (HPT) was studied both for the crystalline state and the liquid crystalline state by using electron crystallography and a molecular simulation approach. In the crystalline state, HPT was found to adopt an orthorhombic P22 1 2 space group with cell parameters a = 36.73 A, b = 27.99 A and c = 4.91 A. Molecular packi1ng calculations were conducted to elucidate the molecular conformation and mutual orientational characteristics in the different states. Phase transitions and relationships are discussed from a structural point of view.
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