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Canonical Orderings of Hexagons That: (1) Nearly Meet the Intent of Patterson's Nomenclature Rules and (2) Orient a Molecule for Purposes of Assigning a IUPAC Name

 

作者: SeymourB. Elk,  

 

期刊: Polycyclic Aromatic Compounds  (Taylor Available online 1990)
卷期: Volume 1, issue 1-2  

页码: 109-121

 

ISSN:1040-6638

 

年代: 1990

 

DOI:10.1080/10406639008034753

 

出版商: Taylor & Francis Group

 

关键词: canonical ordering of hexagons;hexagons;canonical ordering;Patterson's orientation and nomenclature rules;I.U.P.A.C. orientation and nomenclature rules;orientation rules for polybenzenes;nomenclature rules for polybenzenes

 

数据来源: Taylor

 

摘要:

A nomenclature technique developed earlier by the author is expanded to produce an ordering of hexagons that nearly meets the original intent of Patterson's nomenclature rules in organic chemistry for a system of polycyclic aromatic hydrocarbons formed using only benzene modules. The result desired is a simple systematic method which orients a figure formed by the fusion of regular hexagonal rings so that, first, there is a maximum number of rings on a horizontal line and, second, that as many of the remaining rings as possible are above and to the right of this horizontal reference line. In the process of trying to formulate such a system, problems that are inherent in interpreting the intent of Patterson's rules and in pragmatically implementing these rules are examined. Furthermore, a minor modification of the technique produces a canonical orientation of a long molecule which can then be used to formulate the I.U.P.A.C. name for this molecule.

 

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