Matches in SemOpenAlex for { <https://semopenalex.org/work/W2790039695> ?p ?o ?g. }
- W2790039695 endingPage "79" @default.
- W2790039695 startingPage "72" @default.
- W2790039695 abstract "The potential of highly polar trifluoroacetic acid as a media for the metal-free aerobic oxidations propagated by phthalimide N-oxyl- (PINO) radical was demonstrated experimentally utilizing N-hydroxyphthalimide (NHPI) as a catalyst and HNO3 or NaNO2 as promoters. The oxidations of toluene, cyclohexane, adamantane, diamantane, and 3-oxadiamantane gave, respectively, benzaldehyde, adipic acid, 1-hydroxyadamantane, 1-hydroxydiamantane, and 9-hydroxy-3-oxadiamantane with up to 90% selectivities under high conversions of starting material. From the density functional theory computations at the M06-2X and B3LYP-D3 levels the polarized transition structures (TS) for the hydrogen abstraction from toluene and benzyl alcohol with highly electrophilic PINO-radical are substantially stabilized by non-covalent interactions (π–π stacking). Such additional stabilization is not present in the TS for the H-abstraction from benzaldehyde thus retarding its over-oxidation to benzoic acid." @default.
- W2790039695 created "2018-03-29" @default.
- W2790039695 creator A5005209277 @default.
- W2790039695 creator A5012677271 @default.
- W2790039695 creator A5017746712 @default.
- W2790039695 creator A5036215036 @default.
- W2790039695 creator A5048259936 @default.
- W2790039695 creator A5069541223 @default.
- W2790039695 creator A5078268541 @default.
- W2790039695 creator A5081583114 @default.
- W2790039695 date "2018-03-01" @default.
- W2790039695 modified "2023-10-05" @default.
- W2790039695 title "Aerobic oxidations with N -hydroxyphthalimide in trifluoroacetic acid" @default.
- W2790039695 cites W1053803938 @default.
- W2790039695 cites W1678270752 @default.
- W2790039695 cites W1893660319 @default.
- W2790039695 cites W1966161952 @default.
- W2790039695 cites W1968169297 @default.
- W2790039695 cites W1971133718 @default.
- W2790039695 cites W1987826642 @default.
- W2790039695 cites W1989789397 @default.
- W2790039695 cites W2001014236 @default.
- W2790039695 cites W2003451906 @default.
- W2790039695 cites W2004437298 @default.
- W2790039695 cites W2004752165 @default.
- W2790039695 cites W2004912117 @default.
- W2790039695 cites W2005008635 @default.
- W2790039695 cites W2005394097 @default.
- W2790039695 cites W2006150067 @default.
- W2790039695 cites W2008533283 @default.
- W2790039695 cites W2009230023 @default.
- W2790039695 cites W2014835582 @default.
- W2790039695 cites W2021992402 @default.
- W2790039695 cites W2022270655 @default.
- W2790039695 cites W2023498358 @default.
- W2790039695 cites W2023730037 @default.
- W2790039695 cites W2026393532 @default.
- W2790039695 cites W2027534066 @default.
- W2790039695 cites W2030700630 @default.
- W2790039695 cites W2038068294 @default.
- W2790039695 cites W2039869185 @default.
- W2790039695 cites W2041853033 @default.
- W2790039695 cites W2043187965 @default.
- W2790039695 cites W2043815684 @default.
- W2790039695 cites W2044019402 @default.
- W2790039695 cites W2045095645 @default.
- W2790039695 cites W2045823206 @default.
- W2790039695 cites W2057220255 @default.
- W2790039695 cites W2061091682 @default.
- W2790039695 cites W2062509911 @default.
- W2790039695 cites W2065547253 @default.
- W2790039695 cites W2065744294 @default.
- W2790039695 cites W2078082523 @default.
- W2790039695 cites W2084140026 @default.
- W2790039695 cites W2084689372 @default.
- W2790039695 cites W2089921200 @default.
- W2790039695 cites W2092157292 @default.
- W2790039695 cites W2093585439 @default.
- W2790039695 cites W2094067811 @default.
- W2790039695 cites W2094316044 @default.
- W2790039695 cites W2094631657 @default.
- W2790039695 cites W2103186976 @default.
- W2790039695 cites W2111049998 @default.
- W2790039695 cites W2117032806 @default.
- W2790039695 cites W2121472148 @default.
- W2790039695 cites W2128778130 @default.
- W2790039695 cites W2136110076 @default.
- W2790039695 cites W2138054937 @default.
- W2790039695 cites W2140421454 @default.
- W2790039695 cites W2142747813 @default.
- W2790039695 cites W2150393389 @default.
- W2790039695 cites W2150697053 @default.
- W2790039695 cites W2154935279 @default.
- W2790039695 cites W2166997796 @default.
- W2790039695 cites W2169640831 @default.
- W2790039695 cites W2188735744 @default.
- W2790039695 cites W2277727563 @default.
- W2790039695 cites W2297357577 @default.
- W2790039695 cites W2313299197 @default.
- W2790039695 cites W2314973899 @default.
- W2790039695 cites W2320489363 @default.
- W2790039695 cites W2322310184 @default.
- W2790039695 cites W2323093214 @default.
- W2790039695 cites W2326061851 @default.
- W2790039695 cites W2329280090 @default.
- W2790039695 cites W2331368237 @default.
- W2790039695 cites W2399442654 @default.
- W2790039695 cites W2400256357 @default.
- W2790039695 cites W2418344743 @default.
- W2790039695 cites W2607638232 @default.
- W2790039695 cites W2618536580 @default.
- W2790039695 cites W2842257063 @default.
- W2790039695 cites W2949192459 @default.
- W2790039695 cites W2949288772 @default.
- W2790039695 cites W2949329891 @default.
- W2790039695 cites W2949512636 @default.
- W2790039695 cites W2950452170 @default.
- W2790039695 doi "https://doi.org/10.1016/j.mcat.2017.12.017" @default.