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Sterical index: a novel, simple tool for the interpretation of organic reaction mechanisms
Authors:
- Ewa Dresler,
- Radwan Allnajar,
- Radomir Jasiński
Abstract
A new, simple index for the quantitative description of steric effects was proposed based on the results of DFT calculations. This effect was connected with the disturbance of synchronicity within transition states of the model Diels-Alder reaction. The obtained results offer the possibility of predicting steric effects determined by alkyl groups for a wide range of bimolecular processes.
- Record ID
- CUT4594c4ec73d746c69d01b14190be5a24
- Publication categories
- ; ;
- Author
- Journal series
- Scientiae Radices, ISSN 2956-4808
- Issue year
- 2023
- Vol
- 2
- No
- 1
- Pages
- 69-74
- Other elements of collation
- rys.; schem.; tab.; Bibliografia (na s.) - 73-74; Bibliografia (liczba pozycji) - 11; Oznaczenie streszczenia - Abstr.; Numeracja w czasopiśmie - Vol. 2, Iss. 1
- Keywords in English
- organic reactivity, steric effect, cycloaddition
- DOI
- DOI:10.58332/scirad2023v2i1a06 Opening in a new tab
- URL
- https://sci-rad.com/2023v02i01a06/ Opening in a new tab
- Language
- eng (en) English
- License
- Score (nominal)
- 20
- Score source
- journalList
- Score
- Uniform Resource Identifier
- https://cris.pk.edu.pl/info/article/CUT4594c4ec73d746c69d01b14190be5a24/
- URN
urn:pkr-prod:CUT4594c4ec73d746c69d01b14190be5a24
* presented citation count is obtained through Internet information analysis, and it is close to the number calculated by the Publish or PerishOpening in a new tab system.