Open Access2‐[Bis(pyrazol‐1‐yl)methyl]‐4‐ tert ‐butyl‐6‐(phenylsulfanyl)phenol
Author(s) -
Sylvestre Isabelle,
Kilner Colin A.,
Halcrow Malcolm A.
Publication year - 2005
Publication title -
acta crystallographica section c
Language(s) - English
Resource type - Journals
eISSN - 1600-5759
pISSN - 0108-2701
DOI - 10.1107/s0108270105007675
Subject(s) - intramolecular force , intermolecular force , hydrogen bond , chemistry , phenol , pyrazole , medicinal chemistry , crystal structure , crystal (programming language) , stereochemistry , crystallography , molecule , organic chemistry , computer science , programming language
The title compound, C 23 H 24 N 4 OS, contains a highly asymmetric bifurcated intramolecular hydrogen bond between the hydroxy group and two pyrazole N atoms. The compound associates into centrosymmetric dimers in the crystal through two unique C—H⋯π interactions, which are in turn linked into a (6,3)‐network through an additional intermolecular C—H⋯N hydrogen bond.