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OBSOLETE : Imine formation from neat aromatic primary amines and benzaldehyde (optimized using (aug)-pcseg-0) (part II)

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Figshare2020-12-29 更新2026-04-08 收录
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Additional Input and output files from quantum chemical computation of the reaction mechanism.<br><br>https://peerj.com/preprints/27710v1/<br><br><br>SUPERSEDED by the computations present in 10.6084/m9.figshare.8794859, which have been published as:<br>"New insights into the mechanism of Schiff base synthesis from aromatic amines in the absence of acid catalyst or polar solvents" PeerJ Organic Chemistry 2, e4 (DOI: 10.7717/peerj-ochem.4)<br>and<br>10.6084/m9.figshare.9893987

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2019-10-29
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