2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile

In the title ferrocene derivative, [Fe(C(5)H(5))(C(9)H(8)NO)], the dihedral angle between the ene­nitrile group and the substituted cyclo­penta­dienyl ring is 71.2 (1)°. The cyclopentadienyl rings of the ferrocene moiety are arranged in an eclipsed conformation. The hy­droxy group, and the correspon...

Descripción completa

Detalles Bibliográficos
Autores principales: Selvanayagam, S., Ravikumar, K., Kathiravan, S., Raghunathan, R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Metal-Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3885001/
https://www.ncbi.nlm.nih.gov/pubmed/24454176
http://dx.doi.org/10.1107/S1600536813031218
_version_ 1782298688137199616
author Selvanayagam, S.
Ravikumar, K.
Kathiravan, S.
Raghunathan, R.
author_facet Selvanayagam, S.
Ravikumar, K.
Kathiravan, S.
Raghunathan, R.
author_sort Selvanayagam, S.
collection PubMed
description In the title ferrocene derivative, [Fe(C(5)H(5))(C(9)H(8)NO)], the dihedral angle between the ene­nitrile group and the substituted cyclo­penta­dienyl ring is 71.2 (1)°. The cyclopentadienyl rings of the ferrocene moiety are arranged in an eclipsed conformation. The hy­droxy group, and the corresponding methine H atom, are disordered over two sets of sites with site-occupancy factors of 0.744 (4) and 0.256 (4). An intra­molecular C—H⋯O close contact is observed. In the crystal, O—H⋯N hydrogen bonds form a C(6) chain along [100].
format Online
Article
Text
id pubmed-3885001
institution National Center for Biotechnology Information
language English
publishDate 2013
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-38850012014-01-17 2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile Selvanayagam, S. Ravikumar, K. Kathiravan, S. Raghunathan, R. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title ferrocene derivative, [Fe(C(5)H(5))(C(9)H(8)NO)], the dihedral angle between the ene­nitrile group and the substituted cyclo­penta­dienyl ring is 71.2 (1)°. The cyclopentadienyl rings of the ferrocene moiety are arranged in an eclipsed conformation. The hy­droxy group, and the corresponding methine H atom, are disordered over two sets of sites with site-occupancy factors of 0.744 (4) and 0.256 (4). An intra­molecular C—H⋯O close contact is observed. In the crystal, O—H⋯N hydrogen bonds form a C(6) chain along [100]. International Union of Crystallography 2013-11-20 /pmc/articles/PMC3885001/ /pubmed/24454176 http://dx.doi.org/10.1107/S1600536813031218 Text en © Selvanayagam et al. 2013 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Metal-Organic Papers
Selvanayagam, S.
Ravikumar, K.
Kathiravan, S.
Raghunathan, R.
2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
title 2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
title_full 2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
title_fullStr 2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
title_full_unstemmed 2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
title_short 2-[(Ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
title_sort 2-[(ferrocen-1-yl)(hy­droxy)meth­yl]prop-2-ene­nitrile
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3885001/
https://www.ncbi.nlm.nih.gov/pubmed/24454176
http://dx.doi.org/10.1107/S1600536813031218
work_keys_str_mv AT selvanayagams 2ferrocen1ylhydroxymethylprop2enenitrile
AT ravikumark 2ferrocen1ylhydroxymethylprop2enenitrile
AT kathiravans 2ferrocen1ylhydroxymethylprop2enenitrile
AT raghunathanr 2ferrocen1ylhydroxymethylprop2enenitrile

Ejemplares similares