A Topological Account of Chirality
Graph invariants may differentiate structural isomers but are inappropriate to account for stereoisomerism and to distinguish between chiral structures. This work is an attempt to address this problem. A chiral function F satisfying condition F(D) = −F(L), where d and l denote enantiomers of the sam...
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| Published in | Journal of Chemical Information and Computer Sciences Vol. 41; no. 6; pp. 1517 - 1520 |
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| Main Authors | , |
| Format | Journal Article |
| Language | English |
| Published |
United States
American Chemical Society
01.11.2001
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| Online Access | Get full text |
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| Summary: | Graph invariants may differentiate structural isomers but are inappropriate to account for stereoisomerism and to distinguish between chiral structures. This work is an attempt to address this problem. A chiral function F satisfying condition F(D) = −F(L), where d and l denote enantiomers of the same structure, has been applied in combination with Randić's index 1χv. The resulting index χc was used to explain the variance in thin-layer chromatographic retention indices. |
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| Bibliography: | istex:29575BC130ABF1D95358E00119F6471FB9A86FC5 ark:/67375/TPS-1X2FJBX4-B ObjectType-Article-1 SourceType-Scholarly Journals-1 ObjectType-Feature-2 content type line 23 |
| ISSN: | 0095-2338 1549-960X 1520-5142 |
| DOI: | 10.1021/ci0100346 |