Cargando…

Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)

The reaction of (2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydra­zine­carbo­thio­amide (common name: cinnamaldehyde-4-phenyl­thio­semi­carbazone) deprotonated with NaOH in ethanol with an ethano­lic suspension of Pd(II) chloride in a 2:1 molar ratio yielded the title compound, [Pd(C(16)H(14)...

Descripción completa

Detalles Bibliográficos
Autores principales: de Melo, Ana Paula Lopes, Martins, Bianca Barreto, Bresolin, Leandro, Tirloni, Bárbara, de Oliveira, Adriano Bof
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626968/
https://www.ncbi.nlm.nih.gov/pubmed/37936860
http://dx.doi.org/10.1107/S2056989023008654
_version_ 1785131442579177472
author de Melo, Ana Paula Lopes
Martins, Bianca Barreto
Bresolin, Leandro
Tirloni, Bárbara
de Oliveira, Adriano Bof
author_facet de Melo, Ana Paula Lopes
Martins, Bianca Barreto
Bresolin, Leandro
Tirloni, Bárbara
de Oliveira, Adriano Bof
author_sort de Melo, Ana Paula Lopes
collection PubMed
description The reaction of (2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydra­zine­carbo­thio­amide (common name: cinnamaldehyde-4-phenyl­thio­semi­carbazone) deprotonated with NaOH in ethanol with an ethano­lic suspension of Pd(II) chloride in a 2:1 molar ratio yielded the title compound, [Pd(C(16)H(14)N(3)S)(2)]. The anionic ligands act as metal chelators, κ(2) N (1) S-donors, forming five-membered rings with a trans-configuration. The Pd(II) ion is fourfold coordinated in a slightly distorted square-planar geometry. For each ligand, one H⋯S and one H⋯N intra­molecular inter­actions are observed, with S(5) and S(6) graph-set motifs. Concerning the H⋯S inter­actions, the coordination sphere resembles a hydrogen-bonded macrocyclic environment-type. In the crystal, the complexes are linked via pairs of H⋯S inter­actions, with graph-set motif R (2) (2)(8), and building a mono-periodic hydrogen-bonded ribbon along [001]. The Hirshfeld surface analysis indicates that the major contributions for the crystal cohesion are: H⋯H (45.3%), H⋯C/C⋯H (28.0%), H⋯S/S⋯H (8.0%) and H⋯N/N⋯H (7.4%).
format Online
Article
Text
id pubmed-10626968
institution National Center for Biotechnology Information
language English
publishDate 2023
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-106269682023-11-07 Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II) de Melo, Ana Paula Lopes Martins, Bianca Barreto Bresolin, Leandro Tirloni, Bárbara de Oliveira, Adriano Bof Acta Crystallogr E Crystallogr Commun Research Communications The reaction of (2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydra­zine­carbo­thio­amide (common name: cinnamaldehyde-4-phenyl­thio­semi­carbazone) deprotonated with NaOH in ethanol with an ethano­lic suspension of Pd(II) chloride in a 2:1 molar ratio yielded the title compound, [Pd(C(16)H(14)N(3)S)(2)]. The anionic ligands act as metal chelators, κ(2) N (1) S-donors, forming five-membered rings with a trans-configuration. The Pd(II) ion is fourfold coordinated in a slightly distorted square-planar geometry. For each ligand, one H⋯S and one H⋯N intra­molecular inter­actions are observed, with S(5) and S(6) graph-set motifs. Concerning the H⋯S inter­actions, the coordination sphere resembles a hydrogen-bonded macrocyclic environment-type. In the crystal, the complexes are linked via pairs of H⋯S inter­actions, with graph-set motif R (2) (2)(8), and building a mono-periodic hydrogen-bonded ribbon along [001]. The Hirshfeld surface analysis indicates that the major contributions for the crystal cohesion are: H⋯H (45.3%), H⋯C/C⋯H (28.0%), H⋯S/S⋯H (8.0%) and H⋯N/N⋯H (7.4%). International Union of Crystallography 2023-10-05 /pmc/articles/PMC10626968/ /pubmed/37936860 http://dx.doi.org/10.1107/S2056989023008654 Text en © Melo et al. 2023 https://creativecommons.org/licenses/by/4.0/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.
spellingShingle Research Communications
de Melo, Ana Paula Lopes
Martins, Bianca Barreto
Bresolin, Leandro
Tirloni, Bárbara
de Oliveira, Adriano Bof
Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)
title Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)
title_full Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)
title_fullStr Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)
title_full_unstemmed Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)
title_short Synthesis, crystal structure and Hirshfeld analysis of trans-bis­{(2E)-N-phenyl-2-[(2E)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) N (1),S}palladium(II)
title_sort synthesis, crystal structure and hirshfeld analysis of trans-bis­{(2e)-n-phenyl-2-[(2e)-3-phenyl-2-propen-1-yl­idene]hydrazinecarbo­thio­amidato-κ(2) n (1),s}palladium(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626968/
https://www.ncbi.nlm.nih.gov/pubmed/37936860
http://dx.doi.org/10.1107/S2056989023008654
work_keys_str_mv AT demeloanapaulalopes synthesiscrystalstructureandhirshfeldanalysisoftransbis2enphenyl22e3phenyl2propen1ylidenehydrazinecarbothioamidatok2n1spalladiumii
AT martinsbiancabarreto synthesiscrystalstructureandhirshfeldanalysisoftransbis2enphenyl22e3phenyl2propen1ylidenehydrazinecarbothioamidatok2n1spalladiumii
AT bresolinleandro synthesiscrystalstructureandhirshfeldanalysisoftransbis2enphenyl22e3phenyl2propen1ylidenehydrazinecarbothioamidatok2n1spalladiumii
AT tirlonibarbara synthesiscrystalstructureandhirshfeldanalysisoftransbis2enphenyl22e3phenyl2propen1ylidenehydrazinecarbothioamidatok2n1spalladiumii
AT deoliveiraadrianobof synthesiscrystalstructureandhirshfeldanalysisoftransbis2enphenyl22e3phenyl2propen1ylidenehydrazinecarbothioamidatok2n1spalladiumii