Works matching IS 1432881X AND DT 2022 AND VI 141 AND IP 2
Results: 4
Mechanistic studies on stereoselective domino [4 + 2]/retro[3 + 2]/[3 + 2] cycloaddition reactions of oxadiazoles with strained and unstrained cycloalkenes.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2022, v. 141, n. 2, p. 1, doi. 10.1007/s00214-022-02872-y
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Theoretical investigation of the mechanism and regioselectivity of the 3-isopropyl-1,6-dimethyl-naphthalene and ar-himachalene in nitration reaction: a MEDT study.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2022, v. 141, n. 2, p. 1, doi. 10.1007/s00214-022-02869-7
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A DFT study of the molecular and electronic structures of cis-dioxidomolybdenum (VI) complex of 8-hydroxyquinoline and 4-benzoyl-3-methyl-1-phenyl-2-pyrazolin-5-one with water.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2022, v. 141, n. 2, p. 1, doi. 10.1007/s00214-022-02868-8
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- Article
First-principle polarizabilities of nanosystems from auxiliary density perturbation theory with MINRES.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2022, v. 141, n. 2, p. 1, doi. 10.1007/s00214-021-02864-4
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- Article