Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties
Semiempirical calculations were performed to carry out a conformational analysis for carbohydrate-derived dienophiles 1-4. For α,β-unsaturated carbonylic compounds 2-4, a good correlation between Diels-Alder reactivity with calculated values for LUMO energies was observed.
Main Authors: | , , |
---|---|
Format: | Article |
Language: | English |
Published: |
MDPI AG
2000-03-01
|
Series: | Molecules |
Subjects: | |
Online Access: | http://www.mdpi.com/1420-3049/5/3/451/ |
_version_ | 1818018995282903040 |
---|---|
author | S. C. Pellegrinet M. T. Baumgartner R. A. Spanevello |
author_facet | S. C. Pellegrinet M. T. Baumgartner R. A. Spanevello |
author_sort | S. C. Pellegrinet |
collection | DOAJ |
description | Semiempirical calculations were performed to carry out a conformational analysis for carbohydrate-derived dienophiles 1-4. For α,β-unsaturated carbonylic compounds 2-4, a good correlation between Diels-Alder reactivity with calculated values for LUMO energies was observed. |
first_indexed | 2024-04-14T07:47:10Z |
format | Article |
id | doaj.art-6bfd5d8b3d7f40dabfcfaff100021d04 |
institution | Directory Open Access Journal |
issn | 1420-3049 |
language | English |
last_indexed | 2024-04-14T07:47:10Z |
publishDate | 2000-03-01 |
publisher | MDPI AG |
record_format | Article |
series | Molecules |
spelling | doaj.art-6bfd5d8b3d7f40dabfcfaff100021d042022-12-22T02:05:18ZengMDPI AGMolecules1420-30492000-03-015345145210.3390/50300451Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic PropertiesS. C. PellegrinetM. T. BaumgartnerR. A. SpanevelloSemiempirical calculations were performed to carry out a conformational analysis for carbohydrate-derived dienophiles 1-4. For α,β-unsaturated carbonylic compounds 2-4, a good correlation between Diels-Alder reactivity with calculated values for LUMO energies was observed.http://www.mdpi.com/1420-3049/5/3/451/n/a |
spellingShingle | S. C. Pellegrinet M. T. Baumgartner R. A. Spanevello Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties Molecules n/a |
title | Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties |
title_full | Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties |
title_fullStr | Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties |
title_full_unstemmed | Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties |
title_short | Reactivity Comparison of D–Glucose–Derived Dienophiles. Analysis of the Conformational and Electronic Properties |
title_sort | reactivity comparison of da¢a€a glucosea¢a€a derived dienophiles analysis of the conformational and electronic properties |
topic | n/a |
url | http://www.mdpi.com/1420-3049/5/3/451/ |
work_keys_str_mv | AT scpellegrinet reactivitycomparisonofdaaaglucoseaaaderiveddienophilesanalysisoftheconformationalandelectronicproperties AT mtbaumgartner reactivitycomparisonofdaaaglucoseaaaderiveddienophilesanalysisoftheconformationalandelectronicproperties AT raspanevello reactivitycomparisonofdaaaglucoseaaaderiveddienophilesanalysisoftheconformationalandelectronicproperties |