Computational modeling of strained alkenes: Choosing the right computational model-Reference-Cited by-同舟云学术

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Computational modeling of strained alkenes: Choosing the right computational model

Published:2017-08-02 Issue:22 Volume:117 Page:e25439
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int J Quantum Chem

Author:

Kekišev Ott¹^ORCID,Burk Peeter¹,Järv Jaak¹

Affiliation:

1. Institute of Chemistry, University of Tartu, Ravila 14a; Tartu 50411 Estonia

Funder

Estonian Ministry of Education

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference45 articles.

1. Evaluation of strain in hydrocarbons. The strain in adamantane and its origin

2. Additivity Rules for the Estimation of Molecular Properties. Thermodynamic Properties

3. Estimation of heats of formation of organic compounds by additivity methods

4. New Group-Contribution Approach to Thermochemical Properties of Organic Compounds: Hydrocarbons and Oxygen-Containing Compounds

5. Alkene Distortion Energies and Torsional Effects Control Reactivities, and Stereoselectivities of Azide Cycloadditions to Norbornene and Substituted Norbornenes

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4. Mechanism and regioselectivity of [Cu-Fe] heterobimetallic-catalyzed hydroboration of pyridines: DFT investigation;Molecular Catalysis;2021-07

5. Strain criteria for alkenes: Two different manifestations;Computational and Theoretical Chemistry;2020-05

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