(RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)

In the title compound, [Fe(C(12)H(16)O(4))(CO)(3)], the diene moiety of the mol­ecule is virtually planar, with a C—C—C—C torsion angle of −1.4 (2)°. The six-membered ring exhibits a boat conformation, with torsion angles of 46.2 (2) and 46.5 (3)° for a double-bond and the two attached Csp (3) atoms...

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Autores principales: Romanski, Steffen, Neudörfl, Jörg-M., Schmalz, Hans-Günther
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Metal-Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3246956/
https://www.ncbi.nlm.nih.gov/pubmed/22219776
http://dx.doi.org/10.1107/S1600536811041298
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author Romanski, Steffen
Neudörfl, Jörg-M.
Schmalz, Hans-Günther
author_facet Romanski, Steffen
Neudörfl, Jörg-M.
Schmalz, Hans-Günther
author_sort Romanski, Steffen
collection PubMed
description In the title compound, [Fe(C(12)H(16)O(4))(CO)(3)], the diene moiety of the mol­ecule is virtually planar, with a C—C—C—C torsion angle of −1.4 (2)°. The six-membered ring exhibits a boat conformation, with torsion angles of 46.2 (2) and 46.5 (3)° for a double-bond and the two attached Csp (3) atoms. The Fe atom is coordinated to all four of the diene C atoms, with bond lengths between 2.041 (2) and 2.117 (2) Å. The Fe(CO)(3) tripod adopts a conformation with one CO ligand eclipsing the Csp (3)—Csp (3) single bond.
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spelling pubmed-32469562012-01-04 (RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0) Romanski, Steffen Neudörfl, Jörg-M. Schmalz, Hans-Günther Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [Fe(C(12)H(16)O(4))(CO)(3)], the diene moiety of the mol­ecule is virtually planar, with a C—C—C—C torsion angle of −1.4 (2)°. The six-membered ring exhibits a boat conformation, with torsion angles of 46.2 (2) and 46.5 (3)° for a double-bond and the two attached Csp (3) atoms. The Fe atom is coordinated to all four of the diene C atoms, with bond lengths between 2.041 (2) and 2.117 (2) Å. The Fe(CO)(3) tripod adopts a conformation with one CO ligand eclipsing the Csp (3)—Csp (3) single bond. International Union of Crystallography 2011-10-12 /pmc/articles/PMC3246956/ /pubmed/22219776 http://dx.doi.org/10.1107/S1600536811041298 Text en © Romanski et al. 2011 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
Romanski, Steffen
Neudörfl, Jörg-M.
Schmalz, Hans-Günther
(RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
title (RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
title_full (RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
title_fullStr (RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
title_full_unstemmed (RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
title_short (RS)-Tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
title_sort (rs)-tricarbon­yl(η(4)-1,3-diacet­oxy-5,5-dimethyl­cyclo­hexa-1,3-diene)iron(0)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3246956/
https://www.ncbi.nlm.nih.gov/pubmed/22219776
http://dx.doi.org/10.1107/S1600536811041298
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