Total π-electron energy of phenylenes: Bounds and approximate expressions

I. Gutman; Ž. Tomović

doi:10.1007/s007060170042

Total π-electron energy of phenylenes: Bounds and approximate expressions

I. Gutman, Ž. Tomović

Research output: Contribution to journal › Article › Academic › peer-review

7 Citations (Scopus)

Abstract

The structure dependence of the total π-electron energy E (and therefore of the thermodynamic stability) of phenylenes is examined. Sharp and narrow upper and lower bounds for E are obtained. The gross part of E (above 99%) is determined by the size of the phenylene molecule, measured by the number h of hexagons. An approximate mathematical form of the dependence of E on h is established.

Original language	English
Pages (from-to)	1023-1029
Number of pages	7
Journal	Monatshefte für Chemie
Volume	132
Issue number	9
DOIs	https://doi.org/10.1007/s007060170042
Publication status	Published - 1 Jan 2001
Externally published	Yes

Keywords

Chemical graph theory
Phenylenes
Total π-electron energy

Access to Document

10.1007/s007060170042

Cite this

@article{fac160dead87488abf1bab6fbbbf2ee1,

title = "Total π-electron energy of phenylenes: Bounds and approximate expressions",

abstract = "The structure dependence of the total π-electron energy E (and therefore of the thermodynamic stability) of phenylenes is examined. Sharp and narrow upper and lower bounds for E are obtained. The gross part of E (above 99%) is determined by the size of the phenylene molecule, measured by the number h of hexagons. An approximate mathematical form of the dependence of E on h is established.",

keywords = "Chemical graph theory, Phenylenes, Total π-electron energy",

author = "I. Gutman and {\v Z}. Tomovi{\'c}",

year = "2001",

month = jan,

day = "1",

doi = "10.1007/s007060170042",

language = "English",

volume = "132",

pages = "1023--1029",

journal = "Monatshefte f{\"u}r Chemie",

issn = "0026-9247",

publisher = "Springer",

number = "9",

}

TY - JOUR

T1 - Total π-electron energy of phenylenes

T2 - Bounds and approximate expressions

AU - Gutman, I.

AU - Tomović, Ž.

PY - 2001/1/1

Y1 - 2001/1/1

N2 - The structure dependence of the total π-electron energy E (and therefore of the thermodynamic stability) of phenylenes is examined. Sharp and narrow upper and lower bounds for E are obtained. The gross part of E (above 99%) is determined by the size of the phenylene molecule, measured by the number h of hexagons. An approximate mathematical form of the dependence of E on h is established.

AB - The structure dependence of the total π-electron energy E (and therefore of the thermodynamic stability) of phenylenes is examined. Sharp and narrow upper and lower bounds for E are obtained. The gross part of E (above 99%) is determined by the size of the phenylene molecule, measured by the number h of hexagons. An approximate mathematical form of the dependence of E on h is established.

KW - Chemical graph theory

KW - Phenylenes

KW - Total π-electron energy

UR - http://www.scopus.com/inward/record.url?scp=57249116141&partnerID=8YFLogxK

U2 - 10.1007/s007060170042

DO - 10.1007/s007060170042

M3 - Article

AN - SCOPUS:57249116141

SN - 0026-9247

VL - 132

SP - 1023

EP - 1029

JO - Monatshefte für Chemie

JF - Monatshefte für Chemie

IS - 9

ER -

Total π-electron energy of phenylenes: Bounds and approximate expressions

Abstract

Keywords

Access to Document

Other files and links

Fingerprint

Cite this