1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione

The asymmetric unit of the title compound, C(15)H(18)N(2)O(2), contains two independent mol­ecules with essentially identical geometries and conformations. The dihedral angles between the benzene and pyrimidine rings in the two mol­ecules are 89.96 (11) and 73.91 (11)°. The six methyl groups are dis...

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Detalles Bibliográficos
Autores principales: Wang, Hong-Sheng, Li, Gong-Chun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344008/
https://www.ncbi.nlm.nih.gov/pubmed/22589917
http://dx.doi.org/10.1107/S1600536812008999
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author Wang, Hong-Sheng
Li, Gong-Chun
author_facet Wang, Hong-Sheng
Li, Gong-Chun
author_sort Wang, Hong-Sheng
collection PubMed
description The asymmetric unit of the title compound, C(15)H(18)N(2)O(2), contains two independent mol­ecules with essentially identical geometries and conformations. The dihedral angles between the benzene and pyrimidine rings in the two mol­ecules are 89.96 (11) and 73.91 (11)°. The six methyl groups are disordered over two sets of sites, with site occupancies of 0.545 (4):0.455 (4) and 0.542 (7):0.458 (7) in the two mol­ecules. The crystal structure is stabilized by N—H⋯O hydrogen bonds.
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spelling pubmed-33440082012-05-15 1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione Wang, Hong-Sheng Li, Gong-Chun Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(15)H(18)N(2)O(2), contains two independent mol­ecules with essentially identical geometries and conformations. The dihedral angles between the benzene and pyrimidine rings in the two mol­ecules are 89.96 (11) and 73.91 (11)°. The six methyl groups are disordered over two sets of sites, with site occupancies of 0.545 (4):0.455 (4) and 0.542 (7):0.458 (7) in the two mol­ecules. The crystal structure is stabilized by N—H⋯O hydrogen bonds. International Union of Crystallography 2012-03-14 /pmc/articles/PMC3344008/ /pubmed/22589917 http://dx.doi.org/10.1107/S1600536812008999 Text en © Wang and Li 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
Wang, Hong-Sheng
Li, Gong-Chun
1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione
title 1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione
title_full 1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione
title_fullStr 1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione
title_full_unstemmed 1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione
title_short 1-(4-tert-Butyl­benz­yl)pyrimidine-2,4(1H,3H)-dione
title_sort 1-(4-tert-butyl­benz­yl)pyrimidine-2,4(1h,3h)-dione
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344008/
https://www.ncbi.nlm.nih.gov/pubmed/22589917
http://dx.doi.org/10.1107/S1600536812008999
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