(4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione

The asymmetric unit of the title compound, C(21)H(23)N(5)OS(2), contains two independent chiral mol­ecules. The two phenyl rings of one mol­ecule form a dihedral angle of 51.95 (7)° and the distance between their centroids is 4.345 (1) Å. In the other mol­ecule, the phenyl rings form a dihedral angl...

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Detalles Bibliográficos
Autores principales: Wang, Meng, Wang, Jungang, Xiang, Jiacheng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3213506/
https://www.ncbi.nlm.nih.gov/pubmed/22091085
http://dx.doi.org/10.1107/S160053681102736X
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author Wang, Meng
Wang, Jungang
Xiang, Jiacheng
author_facet Wang, Meng
Wang, Jungang
Xiang, Jiacheng
author_sort Wang, Meng
collection PubMed
description The asymmetric unit of the title compound, C(21)H(23)N(5)OS(2), contains two independent chiral mol­ecules. The two phenyl rings of one mol­ecule form a dihedral angle of 51.95 (7)° and the distance between their centroids is 4.345 (1) Å. In the other mol­ecule, the phenyl rings form a dihedral angle of 58.79 (8)° with a ring centroid–centroid distance of 4.435 (2) Å. An intra­molecular O—H⋯N hydrogen bond occurs in each independent mol­ecule. The crystal packing is stabilized by and inter­molecular N—H⋯O and N—H⋯S hydrogen bonds and C—H⋯S inter­actions.
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spelling pubmed-32135062011-11-16 (4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione Wang, Meng Wang, Jungang Xiang, Jiacheng Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(21)H(23)N(5)OS(2), contains two independent chiral mol­ecules. The two phenyl rings of one mol­ecule form a dihedral angle of 51.95 (7)° and the distance between their centroids is 4.345 (1) Å. In the other mol­ecule, the phenyl rings form a dihedral angle of 58.79 (8)° with a ring centroid–centroid distance of 4.435 (2) Å. An intra­molecular O—H⋯N hydrogen bond occurs in each independent mol­ecule. The crystal packing is stabilized by and inter­molecular N—H⋯O and N—H⋯S hydrogen bonds and C—H⋯S inter­actions. International Union of Crystallography 2011-07-16 /pmc/articles/PMC3213506/ /pubmed/22091085 http://dx.doi.org/10.1107/S160053681102736X Text en © Wang et al. 2011 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, Meng
Wang, Jungang
Xiang, Jiacheng
(4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
title (4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
title_full (4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
title_fullStr (4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
title_full_unstemmed (4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
title_short (4R,11R)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
title_sort (4r,11r)-9-(1-hydroxypropan-2-yl)-4,11-diphenyl-1,3,5,7,9-pentaazatri­cyclo[5.3.1.0(4,11)]undecane-2,6-dithione
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3213506/
https://www.ncbi.nlm.nih.gov/pubmed/22091085
http://dx.doi.org/10.1107/S160053681102736X
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