Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine

The title compound, C(26)H(36)N(2)O(2), crystallizes in the phenol–imine form. In the mol­ecule, there are intra­molecular O—H⋯N hydrogen bonds forming S(6) ring motifs, and the two aromatic rings are inclined to each other by 37.9 (7)°. In the crystal, mol­ecules are linked by pairs of weak C—H⋯O h...

Descripción completa

Detalles Bibliográficos
Autores principales: Sen, Pinar, Kansiz, Sevgi, Golenya, Irina A., Dege, Necmi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6073007/
https://www.ncbi.nlm.nih.gov/pubmed/30116581
http://dx.doi.org/10.1107/S2056989018009726
_version_ 1783344096751910912
author Sen, Pinar
Kansiz, Sevgi
Golenya, Irina A.
Dege, Necmi
author_facet Sen, Pinar
Kansiz, Sevgi
Golenya, Irina A.
Dege, Necmi
author_sort Sen, Pinar
collection PubMed
description The title compound, C(26)H(36)N(2)O(2), crystallizes in the phenol–imine form. In the mol­ecule, there are intra­molecular O—H⋯N hydrogen bonds forming S(6) ring motifs, and the two aromatic rings are inclined to each other by 37.9 (7)°. In the crystal, mol­ecules are linked by pairs of weak C—H⋯O hydrogen bonds, forming inversion dimers. Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from H⋯H (77.5%), H⋯C/C⋯H (16%), H⋯O/O⋯H (3.1%) and H⋯N/N⋯H (1.7%) inter­actions.
format Online
Article
Text
id pubmed-6073007
institution National Center for Biotechnology Information
language English
publishDate 2018
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-60730072018-08-16 Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine Sen, Pinar Kansiz, Sevgi Golenya, Irina A. Dege, Necmi Acta Crystallogr E Crystallogr Commun Research Communications The title compound, C(26)H(36)N(2)O(2), crystallizes in the phenol–imine form. In the mol­ecule, there are intra­molecular O—H⋯N hydrogen bonds forming S(6) ring motifs, and the two aromatic rings are inclined to each other by 37.9 (7)°. In the crystal, mol­ecules are linked by pairs of weak C—H⋯O hydrogen bonds, forming inversion dimers. Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from H⋯H (77.5%), H⋯C/C⋯H (16%), H⋯O/O⋯H (3.1%) and H⋯N/N⋯H (1.7%) inter­actions. International Union of Crystallography 2018-07-24 /pmc/articles/PMC6073007/ /pubmed/30116581 http://dx.doi.org/10.1107/S2056989018009726 Text en © Sen et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Sen, Pinar
Kansiz, Sevgi
Golenya, Irina A.
Dege, Necmi
Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
title Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
title_full Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
title_fullStr Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
title_full_unstemmed Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
title_short Crystal structure and Hirshfeld surface analysis of N,N′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
title_sort crystal structure and hirshfeld surface analysis of n,n′-bis­(3-tert-butyl-2-hy­droxy-5-methyl­benzyl­idene)ethane-1,2-di­amine
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6073007/
https://www.ncbi.nlm.nih.gov/pubmed/30116581
http://dx.doi.org/10.1107/S2056989018009726
work_keys_str_mv AT senpinar crystalstructureandhirshfeldsurfaceanalysisofnnbis3tertbutyl2hydroxy5methylbenzylideneethane12diamine
AT kansizsevgi crystalstructureandhirshfeldsurfaceanalysisofnnbis3tertbutyl2hydroxy5methylbenzylideneethane12diamine
AT golenyairinaa crystalstructureandhirshfeldsurfaceanalysisofnnbis3tertbutyl2hydroxy5methylbenzylideneethane12diamine
AT degenecmi crystalstructureandhirshfeldsurfaceanalysisofnnbis3tertbutyl2hydroxy5methylbenzylideneethane12diamine

Ejemplares similares