DESCRIPTION OF CYCLIC AND BRANCHED-ACYCLIC HYDROCARBONS BY VARIANTS OF THE HYPER-WIENER INDEX

被引:7
作者
LINERT, W [1 ]
KLEESTORFER, K [1 ]
RENZ, F [1 ]
LUKOVITS, I [1 ]
机构
[1] HUNGARIAN ACAD SCI, CENT RES INST CHEM, H-1525 BUDAPEST, HUNGARY
来源
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1995年 / 337卷 / 02期
关键词
ACYCLIC; HYDROCARBON; HYPER-WIENER INDEX;
D O I
10.1016/0166-1280(95)04129-T
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
The hyper-Wiener index R was originally defined for acyclic structures. Four different techniques have been proposed so far in order to extend this definition for cycle-containing structures. A computational method for the ''delete path'' version of R is presented for molecules containing a single cycle and a side branch. Formulas for simple cycles are derived for the ''delete path'' and for the ''count path'' versions of R. The variants of the hyper-Wiener number are compared with respect to their use in quantitative structure-property relationships.
引用
收藏
页码:121 / 127
页数:7
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