Synthesis, crystal structure and Hirshfeld surface analysis of 1-ferrocenylundecane-1,11-diol.

Acta Crystallogr E Crystallogr Commun

Department of Chemistry, University of Otago, PO Box 56, Dunedin, New Zealand.

Published: January 2022

The racemic title compound, [Fe(CH)(CHO)], comprises an α,ω-diol-substituted undecyl chain with a ferrocenyl substituent at at one terminus. The alkane chain is inclined to the substituted ring of the ferrocene grouping by 84.22 (13)°. The ferrocene rings are almost eclipsed and parallel. The crystal structure features O-H⋯O and C-H⋯O hydrogen bonds and C-H⋯π contacts that stack the mol-ecules along the axis direction. A Hirshfeld surface analysis reveals that H⋯H inter-actions (83.2%) dominate the surface contacts.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC8819429PMC
http://dx.doi.org/10.1107/S205698902101358XDOI Listing

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