Literature DB >> 14980662

Correlations between the benzene character of acenes or helicenes and simple molecular descriptors.

Padmakar V Khadikar1, Sheela Joshi, Amrit V Bajaj, Dheeraj Mandloi.   

Abstract

Aromatic stabilities of acenes and helicenes, which are responsible for their biological, environmental and cancerous behavior have been modeled using a newly introduced Sadhana (Sd) and A indices. The results are compared with those obtained from PI (Padmakar-Ivan) index. The regression analysis has shown that excellent results are obtained by considering acenes and helicenes as separate classes of isomeric benzenoid hydrocarbons and that A index is better index than both PI and Sd indices.

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Year:  2004        PMID: 14980662     DOI: 10.1016/j.bmcl.2003.12.062

Source DB:  PubMed          Journal:  Bioorg Med Chem Lett        ISSN: 0960-894X            Impact factor:   2.823


  1 in total

1.  Certain polynomials and related topological indices for the series of benzenoid graphs.

Authors:  Muhammad Nadeem; Awais Yousaf; Hanan Alolaiyan; Abdul Razaq
Journal:  Sci Rep       Date:  2019-06-24       Impact factor: 4.379

  1 in total

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