Ordering of alkane isomers by means of connectivity indices

被引:15
|
作者
Gutman, I [1 ]
Vidovic, D [1 ]
Nedic, A [1 ]
机构
[1] Univ Kragujevac, Fac Sci, YU-34000 Kragujevac, Yugoslavia
关键词
connectivity index; Randic index; alkanes; isomer ordering;
D O I
10.2298/JSC0202087G
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The connectivity index of an organic molecule whose molecular graph is G is defined as C(lambda) = Sigma(delta(u)delta(v))(lambda), where delta(u) is the degree of the vertex u in G, where the summation goes over all pairs of adjacent vertices of G and where lambda is a pertinently chosen exponent. The usual value of lambda is -1/2, in which case chi = C(-1/2) is referred to as the Randie index. The ordering of isomeric alkanes according to chi follows the extent of branching of the carbon-atom skeleton, We now study the ordering of the constitutional isomers of alkanes with 6 through 10 carbon atoms with respect to C(lambda) for various values of the parameter lambda. This ordering significantly depends on lambda. The difference between the orderings with respect to chi and with respect to C(lambda) is measured by a function Delta and the lambda-dependence of Delta was established.
引用
收藏
页码:87 / 97
页数:11
相关论文
共 50 条
  • [41] Status connectivity indices of line graphs
    Ramane, Harishchandra S.
    Talwar, Saroja Y.
    AFRIKA MATEMATIKA, 2021, 32 (7-8) : 1615 - 1627
  • [42] Power Indices in Spanning Connectivity Games
    Aziz, Haris
    Lachish, Oded
    Paterson, Mike
    Savani, Rahul
    ALGORITHMIC ASPECTS IN INFORMATION AND MANAGEMENT, PROCEEDINGS, 2009, 5564 : 55 - 67
  • [43] On the maximal eccentric connectivity indices of graphs
    ZHANG Jianbin
    LIU Zhongzhu
    ZHOU Bo
    AppliedMathematics:AJournalofChineseUniversities(SeriesB), 2014, 29 (03) : 374 - 378
  • [44] Status connectivity indices of line graphs
    Harishchandra S. Ramane
    Saroja Y. Talwar
    Afrika Matematika, 2021, 32 : 1615 - 1627
  • [45] Improved superaugmented eccentric connectivity indices
    Dutt, Rohit
    Singh, Monika
    Madan, A. K.
    MEDICINAL CHEMISTRY RESEARCH, 2012, 21 (07) : 1226 - 1236
  • [46] Physicochemical interpretation of molecular connectivity indices
    Estrada, E
    JOURNAL OF PHYSICAL CHEMISTRY A, 2002, 106 (39): : 9085 - 9091
  • [47] On the monotonicity of topological indices and the connectivity of a graph
    Wu, Renfang
    Chen, Hanlin
    Deng, Hanyuan
    APPLIED MATHEMATICS AND COMPUTATION, 2017, 298 : 188 - 200
  • [48] Indices as means to joint reference
    Baltzer, U
    ZEITSCHRIFT FUR SEMIOTIK, 1999, 21 (01): : 43 - 58
  • [49] Topological effects on separation of alkane isomers in metal-organic frameworks
    Bobbitt, N. Scott
    Rosen, Andrew S.
    Snurr, Randall Q.
    FLUID PHASE EQUILIBRIA, 2020, 519
  • [50] ISOMERS OF LONG-CHAIN ALKANE DERIVATIVES AND NERVOUS IMPULSE BLOCKAGE
    REQUENA, J
    VELAZ, ME
    GUERRERO, JR
    MEDINA, JD
    JOURNAL OF MEMBRANE BIOLOGY, 1985, 84 (03): : 229 - 238