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Frontispiece: Intramolecular S E Ar Reactions of Phosphorus Compounds: Computational Approach to the Synthesis of π‐Extended Heterocycles
Author(s) -
Larrañaga Olatz,
RomeroNieto Carlos,
de Cózar Abel
Publication year - 2017
Publication title -
chemistry – a european journal
Language(s) - English
Resource type - Reports
SCImago Journal Rank - 1.687
H-Index - 242
eISSN - 1521-3765
pISSN - 0947-6539
DOI - 10.1002/chem.201786964
Subject(s) - intramolecular force , reactivity (psychology) , phosphorus , combinatorial chemistry , chemistry , catalysis , computer science , computational chemistry , stereochemistry , organic chemistry , medicine , alternative medicine , pathology
A detailed structure‐reactivity investigation within a DFT framework uncovers the crucial synthetic aspects to assemble six‐membered phosphorus heterocycles into heteropolyaromatic hydrocarbons. A theoretical analysis on the preparation of novel phosphorus‐based p‐extended architectures through non‐catalyzed S E Ar is presented. For more information, see the Communication by C. Romero‐Nieto, A. de Cózar et al. on page 17487 ff.