Crystal structures and isometricity comparison of methylated bisphenol F derivatives

Tobias Gruber, Robert Nestler, Wilhelm Seichter, P. Bombicz

Research output: Contribution to journalArticle

7 Citations (Scopus)

Abstract

The syntheses and X-ray structures of three methylated bisphenol F derivatives and one respective analogue are reported. A special emphasis lies on the influence of methyl groups on the conformation of the common diphenylmethane scaffold. The introduction of four methyl groups to bisphenol F was found not to disturb its typical strong hydrogen bond network, and yet, to change the pattern of the aromatic interactions in the overall packing. According to the isometricity comparison, the addition of methyl groups to the diphenylmethane core has a greater influence on the conformation of the individual molecules, than the presence or absence of hydrogen bonding donors or acceptors.

Original languageEnglish
Pages (from-to)319-325
Number of pages7
JournalJournal of Molecular Structure
Volume1056-1057
Issue number1
DOIs
Publication statusPublished - 2014

Fingerprint

Conformations
Hydrogen bonds
Crystal structure
Derivatives
Scaffolds
X rays
Molecules
diphenylmethane

Keywords

  • Bisphenol
  • C-Hâ̄π-interaction
  • Estrogenic activity
  • Isometricity comparison
  • Keywords
  • Single crystal X-ray structure

ASJC Scopus subject areas

  • Spectroscopy
  • Analytical Chemistry
  • Inorganic Chemistry
  • Organic Chemistry

Cite this

Crystal structures and isometricity comparison of methylated bisphenol F derivatives. / Gruber, Tobias; Nestler, Robert; Seichter, Wilhelm; Bombicz, P.

In: Journal of Molecular Structure, Vol. 1056-1057, No. 1, 2014, p. 319-325.

Research output: Contribution to journalArticle

Gruber, Tobias ; Nestler, Robert ; Seichter, Wilhelm ; Bombicz, P. / Crystal structures and isometricity comparison of methylated bisphenol F derivatives. In: Journal of Molecular Structure. 2014 ; Vol. 1056-1057, No. 1. pp. 319-325.
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