Cytenamide acetic acid solvate

In the crystal structure of the title compound (systematic name: 5H-dibenzo[a,d]cyclo­hepta­triene-5-carboxamide ethanoic acid solvate), C(16)H(13)NO·C(2)H(4)O(2), the cytenamide and solvent mol­ecules form a hydrogen-bonded R (2) (2)(8) dimer motif, which is further connected to form a centrosymmet...

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Detalles Bibliográficos
Autores principales: Johnston, Andrea, Florence, Alastair J., Fabianni, Francesca J. A., Shankland, Kenneth, Bedford, Colin T.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961612/
https://www.ncbi.nlm.nih.gov/pubmed/21202682
http://dx.doi.org/10.1107/S160053680801550X
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author Johnston, Andrea
Florence, Alastair J.
Fabianni, Francesca J. A.
Shankland, Kenneth
Bedford, Colin T.
author_facet Johnston, Andrea
Florence, Alastair J.
Fabianni, Francesca J. A.
Shankland, Kenneth
Bedford, Colin T.
author_sort Johnston, Andrea
collection PubMed
description In the crystal structure of the title compound (systematic name: 5H-dibenzo[a,d]cyclo­hepta­triene-5-carboxamide ethanoic acid solvate), C(16)H(13)NO·C(2)H(4)O(2), the cytenamide and solvent mol­ecules form a hydrogen-bonded R (2) (2)(8) dimer motif, which is further connected to form a centrosymmetric double ring motif arrangement. The cycloheptene ring adopts a boat conformation and the dihedral angle between the least-squares planes through the two aromatic rings is 54.7 (2)°.
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spelling pubmed-29616122010-12-30 Cytenamide acetic acid solvate Johnston, Andrea Florence, Alastair J. Fabianni, Francesca J. A. Shankland, Kenneth Bedford, Colin T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title compound (systematic name: 5H-dibenzo[a,d]cyclo­hepta­triene-5-carboxamide ethanoic acid solvate), C(16)H(13)NO·C(2)H(4)O(2), the cytenamide and solvent mol­ecules form a hydrogen-bonded R (2) (2)(8) dimer motif, which is further connected to form a centrosymmetric double ring motif arrangement. The cycloheptene ring adopts a boat conformation and the dihedral angle between the least-squares planes through the two aromatic rings is 54.7 (2)°. International Union of Crystallography 2008-05-30 /pmc/articles/PMC2961612/ /pubmed/21202682 http://dx.doi.org/10.1107/S160053680801550X Text en © Johnston et al. 2008 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
Johnston, Andrea
Florence, Alastair J.
Fabianni, Francesca J. A.
Shankland, Kenneth
Bedford, Colin T.
Cytenamide acetic acid solvate
title Cytenamide acetic acid solvate
title_full Cytenamide acetic acid solvate
title_fullStr Cytenamide acetic acid solvate
title_full_unstemmed Cytenamide acetic acid solvate
title_short Cytenamide acetic acid solvate
title_sort cytenamide acetic acid solvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961612/
https://www.ncbi.nlm.nih.gov/pubmed/21202682
http://dx.doi.org/10.1107/S160053680801550X
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AT florencealastairj cytenamideaceticacidsolvate
AT fabiannifrancescaja cytenamideaceticacidsolvate
AT shanklandkenneth cytenamideaceticacidsolvate
AT bedfordcolint cytenamideaceticacidsolvate

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