Z,E-Isomerism in a Series of Substituted Iminophosphonates: Quantum Chemical Research
Abstract
:1. Introduction
2. Methods of Calculations
3. Results
4. Discussion
Supplementary Materials
Author Contributions
Funding
Institutional Review Board Statement
Informed Consent Statement
Data Availability Statement
Acknowledgments
Conflicts of Interest
References
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Entry | R1 | R2 | R3 | Z/E | ΔG(Z/E) a |
---|---|---|---|---|---|
1 | H | CF3 | Et | 10:1 [12] | |
2 | H | CHF2 | Et | 5:1 | |
3 | H | C3F7 | Et | 20:1 | |
4 | Ph | CF3 | Et | 7:1 | −16.0 |
5 | 4-MeOC6H4 | CF3 | Me | 5:1 [9] | −14.4 |
6 | 4-CNC6H4 | CF3 | Me | 7:1 [9] | −19.7 |
7 | Me | CF3 | Et | 10:1 | |
8 | cyc-Pr | CF3 | Et | 11:1 [11] | −5.9 |
9 | Me | Ph | Et | 1:17 [9] | |
10 | CHMe2 | Ph | Et | 1:20 | |
11 | 4-MeOC6H4 | Ph | Et | 1:13 |
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Rozhenko, A.B.; Kyrylchuk, A.A.; Lapinska, Y.O.; Rassukana, Y.V.; Trachevsky, V.V.; Pirozhenko, V.V.; Leszczynski, J.; Onysko, P.P. Z,E-Isomerism in a Series of Substituted Iminophosphonates: Quantum Chemical Research. Organics 2021, 2, 84-97. https://doi.org/10.3390/org2020008
Rozhenko AB, Kyrylchuk AA, Lapinska YO, Rassukana YV, Trachevsky VV, Pirozhenko VV, Leszczynski J, Onysko PP. Z,E-Isomerism in a Series of Substituted Iminophosphonates: Quantum Chemical Research. Organics. 2021; 2(2):84-97. https://doi.org/10.3390/org2020008
Chicago/Turabian StyleRozhenko, Alexander B., Andrey A. Kyrylchuk, Yuliia O. Lapinska, Yuliya V. Rassukana, Vladimir V. Trachevsky, Volodymyr V. Pirozhenko, Jerzy Leszczynski, and Petro P. Onysko. 2021. "Z,E-Isomerism in a Series of Substituted Iminophosphonates: Quantum Chemical Research" Organics 2, no. 2: 84-97. https://doi.org/10.3390/org2020008