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http://nopr.niscpr.res.in/handle/123456789/40308Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Estrada, Ernesto | - |
| dc.contributor.author | Torres, Luis | - |
| dc.contributor.author | Rodriguez, Lissette | - |
| dc.contributor.author | Gutman, Ivan | - |
| dc.date.accessioned | 2017-02-09T11:34:13Z | - |
| dc.date.available | 2017-02-09T11:34:13Z | - |
| dc.date.issued | 1998-10 | - |
| dc.identifier.issn | 0975-0975(Online); 0376-4710(Print) | - |
| dc.identifier.uri | http://nopr.niscair.res.in/handle/123456789/40308 | - |
| dc.description | 849-855 | en_US |
| dc.description.abstract | The atom-bond connectivity index (ABC), a novel graph theoretical invariant, based on the connectivity between atoms and bonds in a molecule, is proposed. This structure-descriptor is computed from the vertex and edge degrees, but in contrast to the original connectivity index of Randic - ABC does not reflect the extent of branching of the molecule. ABC is used to describe the heats of formation of alkanes, resulting in a good quantitative structure-property relationship (QSPR) model ( r = 0.9970). The model is interpreted in such a manner that the intercept and slope of the regression equation have a physical meaning. | en_US |
| dc.language.iso | en_US | en_US |
| dc.publisher | NISCAIR-CSIR, India | en_US |
| dc.rights |  CC Attribution-Noncommercial-No Derivative Works 2.5 India | en_US |
| dc.source | IJC-A Vol.37A(10) [October 1998] | en_US |
| dc.title | An atom-bond connectivity index: Modelling the enthalpy of formation of alkanes | en_US |
| dc.type | Article | en_US |
| Appears in Collections: | IJC-A Vol.37A(10) [October 1998] | |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| IJCA 37A(10) 849-855.pdf | 656 kB | Adobe PDF | View/Open |
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