4.7 Article

α-Oligofurans show a sizeable extent of π-conjugation as probed by Raman spectroscopy

期刊

CHEMICAL COMMUNICATIONS
卷 48, 期 53, 页码 6732-6734

出版社

ROYAL SOC CHEMISTRY
DOI: 10.1039/c2cc18144d

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资金

  1. Ministerio de Ciencia e Innovacion (MICINN) [CTQ2009-10098]
  2. Junta de Andalucia [PO9-FQM-4708]
  3. MINERVA foundation
  4. Israel Science Foundation
  5. Helen and Martin Kimmel Center for Molecular Design

向作者/读者索取更多资源

A Raman spectroscopic analysis revealed that pi-conjugation does not reach saturation at least up to the octamer in long alpha-oligofurans and spreads over 14-15 furan units in the polyfuran. Comparing DFT calculations with experimental results suggests that a considerable amount of HF exchange is required to reproduce computationally the observed conjugation.

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