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Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)

The asymmetric unit of the title compound, [Mn(C(7)H(4)NO(4))(2)(C(6)H(6)N(2)O)(2)(H(2)O)(2)], contains one Mn(II) atom, one 4-nitro­benzoate (NB) anion, one nicotinamide (NA) ligand and one water mol­ecule; NA and NB each act as a monodentate ligand. The Mn(II) atom, lying on an inversion centre, i...

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Autores principales: Aşkın, Gülçin Şefiye, Necefoğlu, Hacali, Tonbul, Ali Murat, Dilek, Nefise, Hökelek, Tuncer
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4908509/
https://www.ncbi.nlm.nih.gov/pubmed/27308012
http://dx.doi.org/10.1107/S2056989016005612
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author Aşkın, Gülçin Şefiye
Necefoğlu, Hacali
Tonbul, Ali Murat
Dilek, Nefise
Hökelek, Tuncer
author_facet Aşkın, Gülçin Şefiye
Necefoğlu, Hacali
Tonbul, Ali Murat
Dilek, Nefise
Hökelek, Tuncer
author_sort Aşkın, Gülçin Şefiye
collection PubMed
description The asymmetric unit of the title compound, [Mn(C(7)H(4)NO(4))(2)(C(6)H(6)N(2)O)(2)(H(2)O)(2)], contains one Mn(II) atom, one 4-nitro­benzoate (NB) anion, one nicotinamide (NA) ligand and one water mol­ecule; NA and NB each act as a monodentate ligand. The Mn(II) atom, lying on an inversion centre, is coordinated by four O atoms and two pyridine N atoms in a distorted octa­hedral geometry. The water mol­ecules are hydrogen bonded to the carboxyl­ate O atoms. The dihedral angle between the carboxyl­ate group and the adjacent benzene ring is 24.4 (3)°, while the benzene and pyridine rings are oriented at a dihedral angle of 86.63 (11)°. In the crystal, O—H⋯O and N—H⋯O hydrogen bonds link the mol­ecules, forming a layer parallel to the ab plane. The layers are further linked via weak C—H⋯O hydrogen bonds, a π–π stacking inter­action [centroid–centroid distance = 3.868 (2) Å] and a weak C—H⋯π inter­action, resulting in a three-dimensional network.
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spelling pubmed-49085092016-06-15 Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II) Aşkın, Gülçin Şefiye Necefoğlu, Hacali Tonbul, Ali Murat Dilek, Nefise Hökelek, Tuncer Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, [Mn(C(7)H(4)NO(4))(2)(C(6)H(6)N(2)O)(2)(H(2)O)(2)], contains one Mn(II) atom, one 4-nitro­benzoate (NB) anion, one nicotinamide (NA) ligand and one water mol­ecule; NA and NB each act as a monodentate ligand. The Mn(II) atom, lying on an inversion centre, is coordinated by four O atoms and two pyridine N atoms in a distorted octa­hedral geometry. The water mol­ecules are hydrogen bonded to the carboxyl­ate O atoms. The dihedral angle between the carboxyl­ate group and the adjacent benzene ring is 24.4 (3)°, while the benzene and pyridine rings are oriented at a dihedral angle of 86.63 (11)°. In the crystal, O—H⋯O and N—H⋯O hydrogen bonds link the mol­ecules, forming a layer parallel to the ab plane. The layers are further linked via weak C—H⋯O hydrogen bonds, a π–π stacking inter­action [centroid–centroid distance = 3.868 (2) Å] and a weak C—H⋯π inter­action, resulting in a three-dimensional network. International Union of Crystallography 2016-04-08 /pmc/articles/PMC4908509/ /pubmed/27308012 http://dx.doi.org/10.1107/S2056989016005612 Text en © Aşkın et al. 2016 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 Research Communications
Aşkın, Gülçin Şefiye
Necefoğlu, Hacali
Tonbul, Ali Murat
Dilek, Nefise
Hökelek, Tuncer
Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)
title Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)
title_full Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)
title_fullStr Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)
title_full_unstemmed Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)
title_short Crystal structure of trans-di­aqua­bis­(nicotinamide-κN (1))bis­(4-nitro­benzoato-κO)manganese(II)
title_sort crystal structure of trans-di­aqua­bis­(nicotinamide-κn (1))bis­(4-nitro­benzoato-κo)manganese(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4908509/
https://www.ncbi.nlm.nih.gov/pubmed/27308012
http://dx.doi.org/10.1107/S2056989016005612
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