Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene

In the title compound, C(26)H(24), the central cyclo­octa­tetra­ene ring has a boat conformation, and the mol­ecule is saddle shaped. The seat is defined by the mean plane of the four-atom attachment points (r.m.s. deviation = 0.014 Å) of the two bicyclo­heptane substituents. These substituents comp...

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Autores principales: Gautreaux, Dixie, Nauman, Tamara R. Schaller, Fronczek, Frank R., Watkins, Steven F.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238874/
https://www.ncbi.nlm.nih.gov/pubmed/22199727
http://dx.doi.org/10.1107/S160053681104493X
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author Gautreaux, Dixie
Nauman, Tamara R. Schaller
Fronczek, Frank R.
Watkins, Steven F.
author_facet Gautreaux, Dixie
Nauman, Tamara R. Schaller
Fronczek, Frank R.
Watkins, Steven F.
author_sort Gautreaux, Dixie
collection PubMed
description In the title compound, C(26)H(24), the central cyclo­octa­tetra­ene ring has a boat conformation, and the mol­ecule is saddle shaped. The seat is defined by the mean plane of the four-atom attachment points (r.m.s. deviation = 0.014 Å) of the two bicyclo­heptane substituents. These substituents comprise the pommel and cantle, with each mean plane defined by four atoms proximate to the seat (r.m.s. deviations = 0.001 and 0.000 Å). Relative to the seat, the pommel and cantle bend up 33.36 (5) and 34.22 (4)°, while the benzo units (flaps, r.m.s. deviations = 0.008 and 0.013 Å) bend down 33.48 (4) and 36.58 (4)°.
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spelling pubmed-32388742011-12-23 Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene Gautreaux, Dixie Nauman, Tamara R. Schaller Fronczek, Frank R. Watkins, Steven F. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(26)H(24), the central cyclo­octa­tetra­ene ring has a boat conformation, and the mol­ecule is saddle shaped. The seat is defined by the mean plane of the four-atom attachment points (r.m.s. deviation = 0.014 Å) of the two bicyclo­heptane substituents. These substituents comprise the pommel and cantle, with each mean plane defined by four atoms proximate to the seat (r.m.s. deviations = 0.001 and 0.000 Å). Relative to the seat, the pommel and cantle bend up 33.36 (5) and 34.22 (4)°, while the benzo units (flaps, r.m.s. deviations = 0.008 and 0.013 Å) bend down 33.48 (4) and 36.58 (4)°. International Union of Crystallography 2011-11-05 /pmc/articles/PMC3238874/ /pubmed/22199727 http://dx.doi.org/10.1107/S160053681104493X Text en © Gautreaux 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 Organic Papers
Gautreaux, Dixie
Nauman, Tamara R. Schaller
Fronczek, Frank R.
Watkins, Steven F.
Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
title Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
title_full Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
title_fullStr Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
title_full_unstemmed Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
title_short Dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
title_sort dibenzo[a,e]penta­cyclo­[12.2.1.1(6,9).0(2,13).0(5.10)]octa­deca-2(13),5(10)-diene
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238874/
https://www.ncbi.nlm.nih.gov/pubmed/22199727
http://dx.doi.org/10.1107/S160053681104493X
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