Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide

The title compound, C(17)H(24)N(2)O(3)S, was synthesized in order to determine the relative configuration of the corresponding β-keto aldehyde. In the U-shaped mol­ecule, the five-membered ring approximates an envelope with the methyl­ene atom adjacent to the quaternary C atom being the flap. The di...

Descripción completa

Detalles Bibliográficos
Autores principales: Tymann, David, Dragon, Dina Christina, Golz, Christopher, Preut, Hans, Strohmann, Carsten, Hiersemann, Martin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384629/
https://www.ncbi.nlm.nih.gov/pubmed/25878892
http://dx.doi.org/10.1107/S2056989014026747
_version_ 1782364935855013888
author Tymann, David
Dragon, Dina Christina
Golz, Christopher
Preut, Hans
Strohmann, Carsten
Hiersemann, Martin
author_facet Tymann, David
Dragon, Dina Christina
Golz, Christopher
Preut, Hans
Strohmann, Carsten
Hiersemann, Martin
author_sort Tymann, David
collection PubMed
description The title compound, C(17)H(24)N(2)O(3)S, was synthesized in order to determine the relative configuration of the corresponding β-keto aldehyde. In the U-shaped mol­ecule, the five-membered ring approximates an envelope with the methyl­ene atom adjacent to the quaternary C atom being the flap. The dihedral angles between the four nearly coplanar atoms of the five-membered ring and the flap and the aromatic ring are 38.8 (4) and 22.9 (2)°, respectively. The bond angles around the S atom are in the range 104.11 (16)–119.95 (16)°. In the crystal, mol­ecules are linked via N—H⋯O by hydrogen bonds, forming a chain along the a-axis direction.
format Online
Article
Text
id pubmed-4384629
institution National Center for Biotechnology Information
language English
publishDate 2015
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-43846292015-04-15 Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide Tymann, David Dragon, Dina Christina Golz, Christopher Preut, Hans Strohmann, Carsten Hiersemann, Martin Acta Crystallogr E Crystallogr Commun Data Reports The title compound, C(17)H(24)N(2)O(3)S, was synthesized in order to determine the relative configuration of the corresponding β-keto aldehyde. In the U-shaped mol­ecule, the five-membered ring approximates an envelope with the methyl­ene atom adjacent to the quaternary C atom being the flap. The dihedral angles between the four nearly coplanar atoms of the five-membered ring and the flap and the aromatic ring are 38.8 (4) and 22.9 (2)°, respectively. The bond angles around the S atom are in the range 104.11 (16)–119.95 (16)°. In the crystal, mol­ecules are linked via N—H⋯O by hydrogen bonds, forming a chain along the a-axis direction. International Union of Crystallography 2015-01-10 /pmc/articles/PMC4384629/ /pubmed/25878892 http://dx.doi.org/10.1107/S2056989014026747 Text en © Tymann et al. 2015 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 Data Reports
Tymann, David
Dragon, Dina Christina
Golz, Christopher
Preut, Hans
Strohmann, Carsten
Hiersemann, Martin
Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
title Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
title_full Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
title_fullStr Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
title_full_unstemmed Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
title_short Crystal structure of (E)-N′-{[(1R,3R)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
title_sort crystal structure of (e)-n′-{[(1r,3r)-3-isopropyl-1-methyl-2-oxo­cyclo­pent­yl]methyl­idene}-4-methyl­benzene­sulfono­hydrazide
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384629/
https://www.ncbi.nlm.nih.gov/pubmed/25878892
http://dx.doi.org/10.1107/S2056989014026747
work_keys_str_mv AT tymanndavid crystalstructureofen1r3r3isopropyl1methyl2oxocyclopentylmethylidene4methylbenzenesulfonohydrazide
AT dragondinachristina crystalstructureofen1r3r3isopropyl1methyl2oxocyclopentylmethylidene4methylbenzenesulfonohydrazide
AT golzchristopher crystalstructureofen1r3r3isopropyl1methyl2oxocyclopentylmethylidene4methylbenzenesulfonohydrazide
AT preuthans crystalstructureofen1r3r3isopropyl1methyl2oxocyclopentylmethylidene4methylbenzenesulfonohydrazide
AT strohmanncarsten crystalstructureofen1r3r3isopropyl1methyl2oxocyclopentylmethylidene4methylbenzenesulfonohydrazide
AT hiersemannmartin crystalstructureofen1r3r3isopropyl1methyl2oxocyclopentylmethylidene4methylbenzenesulfonohydrazide

Ejemplares similares