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(2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)

The whole mol­ecule of the title β-enamino­ester, C(16)H(28)N(2)O(4), is generated by a crystallographic inversion center, situated at the mid-point of the central C—C bond of the 1,4-diamino­butane segment. There are two intra­molecular N—H⋯O hydrogen bonds that generate S(6) ring motifs. This lead...

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Autores principales: Harrad, Mohamed Anouar, Boualy, Brahim, Ali, Mustapha Ait, El Firdoussi, Larbi, Stoeckli-Evans, Helen
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470214/
https://www.ncbi.nlm.nih.gov/pubmed/23125658
http://dx.doi.org/10.1107/S1600536812036823
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author Harrad, Mohamed Anouar
Boualy, Brahim
Ali, Mustapha Ait
El Firdoussi, Larbi
Stoeckli-Evans, Helen
author_facet Harrad, Mohamed Anouar
Boualy, Brahim
Ali, Mustapha Ait
El Firdoussi, Larbi
Stoeckli-Evans, Helen
author_sort Harrad, Mohamed Anouar
collection PubMed
description The whole mol­ecule of the title β-enamino­ester, C(16)H(28)N(2)O(4), is generated by a crystallographic inversion center, situated at the mid-point of the central C—C bond of the 1,4-diamino­butane segment. There are two intra­molecular N—H⋯O hydrogen bonds that generate S(6) ring motifs. This leads to the Z conformation about the C=C bonds [1.3756 (17) Å]. The mol­ecule is S-shaped with the planar central 1,4-diamino­butane segment [maximum deviation for non H-atoms = 0.0058 (13) Å] being inclined to the ethyl butyl­enonate fragment [C—C—O—C—C=C—C; maximum deviation = 0.0710 (12) Å] by 15.56 (10)°. In the crystal, mol­ecules are linked via C—H⋯O inter­actions, leading to the formation of an undulating two-dimensional network lying parallel to the bc plane.
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spelling pubmed-34702142012-11-02 (2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate) Harrad, Mohamed Anouar Boualy, Brahim Ali, Mustapha Ait El Firdoussi, Larbi Stoeckli-Evans, Helen Acta Crystallogr Sect E Struct Rep Online Organic Papers The whole mol­ecule of the title β-enamino­ester, C(16)H(28)N(2)O(4), is generated by a crystallographic inversion center, situated at the mid-point of the central C—C bond of the 1,4-diamino­butane segment. There are two intra­molecular N—H⋯O hydrogen bonds that generate S(6) ring motifs. This leads to the Z conformation about the C=C bonds [1.3756 (17) Å]. The mol­ecule is S-shaped with the planar central 1,4-diamino­butane segment [maximum deviation for non H-atoms = 0.0058 (13) Å] being inclined to the ethyl butyl­enonate fragment [C—C—O—C—C=C—C; maximum deviation = 0.0710 (12) Å] by 15.56 (10)°. In the crystal, mol­ecules are linked via C—H⋯O inter­actions, leading to the formation of an undulating two-dimensional network lying parallel to the bc plane. International Union of Crystallography 2012-09-05 /pmc/articles/PMC3470214/ /pubmed/23125658 http://dx.doi.org/10.1107/S1600536812036823 Text en © Harrad et al. 2012 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
Harrad, Mohamed Anouar
Boualy, Brahim
Ali, Mustapha Ait
El Firdoussi, Larbi
Stoeckli-Evans, Helen
(2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
title (2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
title_full (2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
title_fullStr (2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
title_full_unstemmed (2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
title_short (2Z,2′Z)-Diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
title_sort (2z,2′z)-diethyl 3,3′-[butane-1,4-diylbis(aza­nedi­yl)]bis­(but-2-enoate)
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470214/
https://www.ncbi.nlm.nih.gov/pubmed/23125658
http://dx.doi.org/10.1107/S1600536812036823
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