423 related articles for article (PubMed ID: 28279822)
1. Computational study of the 1,3-dipolar cycloaddition between methyl 2-trifluorobutynoate and substituted azides in terms of reactivity indices and activation parameters.
Salah M; Komiha N; Kabbaj OK; Ghailane R; Marakchi K
J Mol Graph Model; 2017 May; 73():143-151. PubMed ID: 28279822
[TBL] [Abstract][Full Text] [Related]
2. The Azide-Allene Dipolar Cycloaddition: Is DFT Able to Predict Site- and Regio-Selectivity?
Molteni G; Ponti A
Molecules; 2021 Feb; 26(4):. PubMed ID: 33578668
[TBL] [Abstract][Full Text] [Related]
3. Reactivity and regioselectivity in 1,3-dipolar cycloadditions of azides to strained alkynes and alkenes: a computational study.
Schoenebeck F; Ess DH; Jones GO; Houk KN
J Am Chem Soc; 2009 Jun; 131(23):8121-33. PubMed ID: 19459632
[TBL] [Abstract][Full Text] [Related]
4. Theoretical study of the 1,3-DC reaction between fluorinated alkynes and azides: Reactivity indices, transition structures, IGM and ELF analysis.
Salah M; Zeroual A; Jorio S; El Hadki H; Kabbaj OK; Marakchi K; Komiha N
J Mol Graph Model; 2020 Jan; 94():107458. PubMed ID: 31726313
[TBL] [Abstract][Full Text] [Related]
5. Regioselectivity of vinyl sulfone based 1,3-dipolar cycloaddition reactions with sugar azides by computational and experimental studies.
Sahu D; Dey S; Pathak T; Ganguly B
Org Lett; 2014 Apr; 16(8):2100-3. PubMed ID: 24697165
[TBL] [Abstract][Full Text] [Related]
6. 1, 3-Dipolar cycloaddition reactions of selected 1,3-dipoles with 7-isopropylidenenorbornadiene and follow-up thermolytic cleavage: A computational study.
Arhin G; Adams AH; Opoku E; Tia R; Adei E
J Mol Graph Model; 2019 Nov; 92():267-279. PubMed ID: 31425904
[TBL] [Abstract][Full Text] [Related]
7. Regio- and stereoselectivity of the [3+2] cycloaddition of nitrones with methyl-acetophenone: A DFT investigation.
Zouaghi MO; Doggui MY; Arfaoui Y
J Mol Graph Model; 2021 Sep; 107():107960. PubMed ID: 34126545
[TBL] [Abstract][Full Text] [Related]
8. 1,3-Dipolar Cycloaddition with Diazo Groups: Noncovalent Interactions Overwhelm Strain.
Gold B; Aronoff MR; Raines RT
Org Lett; 2016 Sep; 18(18):4466-4469. PubMed ID: 27599159
[TBL] [Abstract][Full Text] [Related]
9. Reactivity and regioselectivity in reactions of methyl and ethyl azides with cyclooctynes: activation strain model and energy decomposition analysis.
de S Vilhena F; de M Carneiro JW
J Mol Model; 2017 Jan; 23(1):14. PubMed ID: 28032223
[TBL] [Abstract][Full Text] [Related]
10. Alkene distortion energies and torsional effects control reactivities, and stereoselectivities of azide cycloadditions to norbornene and substituted norbornenes.
Lopez SA; Houk KN
J Org Chem; 2013 Mar; 78(5):1778-83. PubMed ID: 22764840
[TBL] [Abstract][Full Text] [Related]
11. A molecular electron density theory study on the [3+2] cycloaddition reaction of 5,5-dimethyl-1-pyrroline N-oxide with 2-cyclopentenone.
Soleymani M; Kazemi Chegeni Z
J Mol Graph Model; 2019 Nov; 92():256-266. PubMed ID: 31422198
[TBL] [Abstract][Full Text] [Related]
12. Electrophilic Azides for Materials Synthesis and Chemical Biology.
Xie S; Sundhoro M; Houk KN; Yan M
Acc Chem Res; 2020 Apr; 53(4):937-948. PubMed ID: 32207916
[TBL] [Abstract][Full Text] [Related]
13. A Molecular Electron Density Theory Study of the Reactivity of Azomethine Imine in [3+2] Cycloaddition Reactions.
Domingo LR; Ríos-Gutiérrez M
Molecules; 2017 May; 22(5):. PubMed ID: 28481228
[TBL] [Abstract][Full Text] [Related]
14. Mechanism and regioselectivity of the reversible Diels-Alder cycloaddition of 2-methyl-1,3 butadiene with C48B6N6 heterofullerene: a DFT approach.
Zahedi E
J Mol Graph Model; 2014 Sep; 53():212-220. PubMed ID: 25203975
[TBL] [Abstract][Full Text] [Related]
15. A Theoretical Study on Stepwise- and Concertedness of the Mechanism of 1,3-Dipolar Cycloaddition Reaction Between Tetra Amino Ethylene and Trifluoro Methyl Azide.
Siadati SA
Comb Chem High Throughput Screen; 2016; 19(2):170-5. PubMed ID: 26673901
[TBL] [Abstract][Full Text] [Related]
16. The Nitrilimine-Alkene Cycloaddition Regioselectivity Rationalized by Density Functional Theory Reactivity Indices.
Molteni G; Ponti A
Molecules; 2017 Jan; 22(2):. PubMed ID: 28134786
[TBL] [Abstract][Full Text] [Related]
17. Theoretical studies on the regioselectivity of iridium-catalyzed 1,3-dipolar azide-alkyne cycloaddition reactions.
Luo Q; Jia G; Sun J; Lin Z
J Org Chem; 2014 Dec; 79(24):11970-80. PubMed ID: 25222638
[TBL] [Abstract][Full Text] [Related]
18. Decreasing Distortion Energies without Strain: Diazo-Selective 1,3-Dipolar Cycloadditions.
Gold B; Aronoff MR; Raines RT
J Org Chem; 2016 Jul; 81(14):5998-6006. PubMed ID: 27332711
[TBL] [Abstract][Full Text] [Related]
19. A theoretical study on the reaction pathways and the mechanism of 1,3- dipolar cycloaddition of vinyl acetylene and methyl azide.
Siadati SA; Mahboobifar A; Nasiri R
Comb Chem High Throughput Screen; 2014; 17(8):703-8. PubMed ID: 24852164
[TBL] [Abstract][Full Text] [Related]
20. Understanding the molecular mechanism and regioselectivity in the synthesis of celecoxib via a domino reaction: A DFT study.
Emamian S
J Mol Graph Model; 2015 Jul; 60():155-61. PubMed ID: 26036921
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
