Journal of Molecular Structure, volume 1250, pages 131649
Ni(II), Pd(II) and Pt(II) complexes of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate: Synthesis, spectroscopic characterization, antimicrobial and molecular docking studies
Madalina Hrubaru
1
,
Emeric Bartha
1
,
Anthony C. Ekennia
2
,
Sunday N Okafor
3
,
Carmellina Daniela Badiceanu
4
,
David Agwu Udu
5
,
Damian C. Onwudiwe
6
,
Sergiu Shova
7
,
Constantin Draghici
1
1
Center of Organic Chemistry “C.D.Nenitescu”, Romanian Academy, Sector 6, Spl. Independentei 202B, Mail Code 060023, P.O box 35-108, Bucharest, Romania
|
2
Department of Chemistry, Alex Ekwueme Federal University, Ndufu-Alike, P.M.B. 1010 Abakiliki, Ebonyi State, Nigeria
|
3
Department of Pharmaceutical and Medicinal Chemistry, University of Nigeria, Nsukka, Enugu State, 410001, Nigeria.
|
4
University of Medicine and Pharmacy, “Carol Davila”, Faculty of Pharmacy, Department of Pharmaceutical Chemistry, 6 Traian Vuia Street, Bucharest 020956, Romania
|
5
Department of Science Education, Alex Ekwueme Federal University, Ndufu-Alike, Ebonyi State, Nigeria
|
7
Petru Poni Institute of Macromolecular Chemistry, Aleea G. Ghica Voda 41A, Iasi 700487, Romania
|
Publication type: Journal Article
Publication date: 2022-02-01
Journal:
Journal of Molecular Structure
Quartile SCImago
Q2
Quartile WOS
Q2
Impact factor: 3.8
ISSN: 00222860
Organic Chemistry
Inorganic Chemistry
Spectroscopy
Analytical Chemistry
Abstract
• Synthesis of a potassium salt of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate and its Ni(II), Pt(II) and Pd(II) complexes. • Single crystal X-ray diffraction studies for Pt (II) and Pd(II) complexes and magnetic susceptibility measure for the Ni(II) complex were done. • Antimicrobial susceptibility screening of the compounds was carried out using Bacillus subtilis, Staphylococcus aureus, Escherichia coli, Pseudomonas aeruginosa, and C. albicans. • Molecular docking studies of the ligand and its coordination compounds with some enzymes responsible for the survival of these microbes were carried out. A potassium salt of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate has been synthesized from three step processes involving the synthesis of bis(3,3-dimethyl-allyl)-cyanamide and subsequent conversion to N,N-bis(3,3-dimethyl-allyl)amine. The dithiocarbamate ligand was obtained in a rapid exothermic reaction involving the amine and carbon disulfide in alkali medium, and its Ni(II), Pt(II) and Pd(II) complexes are reported. The characterization of the ligand and its metal complexes were carried out using various spectroscopic (FTIR, NMR, Mass) and magnetic susceptibility measurements. Square planar structures were proposed for the complexes as obtained from single crystal X-ray diffraction studies for Pt (II) and Pd(II) complexes and magnetic moment study for the Ni(II) complex. Antimicrobial susceptibility screening of the compounds was carried out using Gram positive strains: Bacillus subtilis and Staphylococcus aureus , Gram negative strains: Escherichia coli and Pseudomonas aeruginosa , and a fungal species: C. albicans . The drugs ciprofloxacin and ketoconazole were used as the reference standard drugs. The metal complexes showed significant antimicrobial activity. Thus, further study on this approach could pave a way for the development of dithiocarbamate-metal complex based antimicrobial agents.
Top-30
Citations by journals
|
1
2
|
|
|
Journal of Molecular Structure
2 publications, 22.22%
|
|
|
Polycyclic Aromatic Compounds
1 publication, 11.11%
|
|
|
Results in Chemistry
1 publication, 11.11%
|
|
|
Inorganica Chimica Acta
1 publication, 11.11%
|
|
|
Journal of Coordination Chemistry
1 publication, 11.11%
|
|
|
Russian Chemical Reviews
1 publication, 11.11%
|
|
|
Medicinal Chemistry Research
1 publication, 11.11%
|
|
|
Journal of the Indian Chemical Society
1 publication, 11.11%
|
|
|
1
2
|
Citations by publishers
|
1
2
3
4
5
|
|
|
Elsevier
5 publications, 55.56%
|
|
|
Taylor & Francis
2 publications, 22.22%
|
|
|
Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii
1 publication, 11.11%
|
|
|
Springer Nature
1 publication, 11.11%
|
|
|
1
2
3
4
5
|
- We do not take into account publications without a DOI.
- Statistics recalculated only for publications connected to researchers, organizations and labs registered on the platform.
- Statistics recalculated weekly.
{"yearsCitations":{"type":"bar","data":{"show":true,"labels":[2022,2023,2024,2025],"ids":[0,0,0,0],"codes":[0,0,0,0],"imageUrls":["","","",""],"datasets":[{"label":"Citations number","data":[2,4,2,1],"backgroundColor":["#3B82F6","#3B82F6","#3B82F6","#3B82F6"],"percentage":["22.22","44.44","22.22","11.11"],"barThickness":null}]},"options":{"indexAxis":"x","maintainAspectRatio":true,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false},"x":{"ticks":{"stepSize":1,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Citations per year","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"journals":{"type":"bar","data":{"show":true,"labels":["Journal of Molecular Structure","Polycyclic Aromatic Compounds","Results in Chemistry","Inorganica Chimica Acta","Journal of Coordination Chemistry","Russian Chemical Reviews","Medicinal Chemistry Research","Journal of the Indian Chemical Society"],"ids":[9347,15253,27927,1406,23053,23802,6106,8441],"codes":[0,0,0,0,0,0,0,0],"imageUrls":["\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/5YZtvLvkPZuc2JHOaZsjCvGSHFCuC3drUwN3YAc5_medium.webp","\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/5YZtvLvkPZuc2JHOaZsjCvGSHFCuC3drUwN3YAc5_medium.webp","\/storage\/images\/resized\/9Mus3KG1Tkd7Bwaurt8H3RwWh0CxRlGoO6ng9UK1_medium.webp","\/storage\/images\/resized\/voXLqlsvTwv5p3iMQ8Dhs95nqB4AXOG7Taj7G4ra_medium.webp",""],"datasets":[{"label":"","data":[2,1,1,1,1,1,1,1],"backgroundColor":["#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6"],"percentage":[22.22,11.11,11.11,11.11,11.11,11.11,11.11,11.11],"barThickness":13}]},"options":{"indexAxis":"y","maintainAspectRatio":false,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false},"x":{"ticks":{"stepSize":null,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Journals","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"publishers":{"type":"bar","data":{"show":true,"labels":["Elsevier","Taylor & Francis","Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii","Springer Nature"],"ids":[17,18,9422,8],"codes":[0,0,0,0],"imageUrls":["\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/5YZtvLvkPZuc2JHOaZsjCvGSHFCuC3drUwN3YAc5_medium.webp","\/storage\/images\/resized\/9Mus3KG1Tkd7Bwaurt8H3RwWh0CxRlGoO6ng9UK1_medium.webp","\/storage\/images\/resized\/voXLqlsvTwv5p3iMQ8Dhs95nqB4AXOG7Taj7G4ra_medium.webp"],"datasets":[{"label":"","data":[5,2,1,1],"backgroundColor":["#3B82F6","#3B82F6","#3B82F6","#3B82F6"],"percentage":[55.56,22.22,11.11,11.11],"barThickness":13}]},"options":{"indexAxis":"y","maintainAspectRatio":false,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false},"x":{"ticks":{"stepSize":null,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Publishers","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"yearsCitationsQuartiles":{"type":"bar","data":{"show":true,"labels":[2022,2023,2024,2025],"ids":[],"codes":[],"imageUrls":[],"datasets":[{"label":"Q4","backgroundColor":"rgb(221,90,78)","data":[0,0,1,0],"percentage":["0","0","11.11","0"]},{"label":"Q3","backgroundColor":"rgb(251, 163,83)","data":[1,2,0,0],"percentage":["11.11","22.22","0","0"]},{"label":"Q2","backgroundColor":"rgb(232, 213, 89)","data":[1,1,1,1],"percentage":["11.11","11.11","11.11","11.11"]},{"label":"Q1","backgroundColor":"rgb(164, 207, 99)","data":[0,1,0,0],"percentage":["0","11.11","0","0"]},{"label":"Quartile not defined","backgroundColor":"#E5E7EB","data":[0,0,0,0],"percentage":["0","0","0","0"]}]},"options":{"indexAxis":"x","maintainAspectRatio":true,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true},"x":{"ticks":{"stepSize":1,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Citations quartiles by SCImago per year","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"yearsCitationsQuartilesWs":{"type":"bar","data":{"show":true,"labels":[2022,2023,2024,2025],"ids":[],"codes":[],"imageUrls":[],"datasets":[{"label":"Q4","backgroundColor":"rgb(221,90,78)","data":[0,0,1,0],"percentage":["0","0","11.11","0"]},{"label":"Q3","backgroundColor":"rgb(251, 163,83)","data":[0,1,1,0],"percentage":["0","11.11","11.11","0"]},{"label":"Q2","backgroundColor":"rgb(232, 213, 89)","data":[1,2,0,1],"percentage":["11.11","22.22","0","11.11"]},{"label":"Q1","backgroundColor":"rgb(164, 207, 99)","data":[0,1,0,0],"percentage":["0","11.11","0","0"]},{"label":"Quartile not defined","backgroundColor":"#E5E7EB","data":[1,0,0,0],"percentage":["11.11","0","0","0"]}]},"options":{"indexAxis":"x","maintainAspectRatio":true,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true},"x":{"ticks":{"stepSize":1,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Citations quartiles by WoS per year","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}}}
Are you a researcher?
Create a profile to get free access to personal recommendations for colleagues and new articles.
Metrics
Cite this
GOST |
RIS |
BibTex
Cite this
GOST
Copy
Hrubaru M. et al. Ni(II), Pd(II) and Pt(II) complexes of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate: Synthesis, spectroscopic characterization, antimicrobial and molecular docking studies // Journal of Molecular Structure. 2022. Vol. 1250. p. 131649.
GOST all authors (up to 50)
Copy
Hrubaru M., Bartha E., Ekennia A. C., Okafor S. N., Badiceanu C. D., Udu D. A., Onwudiwe D. C., Shova S., Draghici C. Ni(II), Pd(II) and Pt(II) complexes of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate: Synthesis, spectroscopic characterization, antimicrobial and molecular docking studies // Journal of Molecular Structure. 2022. Vol. 1250. p. 131649.
Cite this
RIS
Copy
TY - JOUR
DO - 10.1016/j.molstruc.2021.131649
UR - https://doi.org/10.1016/j.molstruc.2021.131649
TI - Ni(II), Pd(II) and Pt(II) complexes of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate: Synthesis, spectroscopic characterization, antimicrobial and molecular docking studies
T2 - Journal of Molecular Structure
AU - Hrubaru, Madalina
AU - Bartha, Emeric
AU - Ekennia, Anthony C.
AU - Okafor, Sunday N
AU - Badiceanu, Carmellina Daniela
AU - Udu, David Agwu
AU - Onwudiwe, Damian C.
AU - Shova, Sergiu
AU - Draghici, Constantin
PY - 2022
DA - 2022/02/01 00:00:00
PB - Elsevier
SP - 131649
VL - 1250
SN - 0022-2860
ER -
Cite this
BibTex
Copy
@article{2022_Hrubaru,
author = {Madalina Hrubaru and Emeric Bartha and Anthony C. Ekennia and Sunday N Okafor and Carmellina Daniela Badiceanu and David Agwu Udu and Damian C. Onwudiwe and Sergiu Shova and Constantin Draghici},
title = {Ni(II), Pd(II) and Pt(II) complexes of N,N-bis(3,3-dimethyl-allyl)-dithiocarbamate: Synthesis, spectroscopic characterization, antimicrobial and molecular docking studies},
journal = {Journal of Molecular Structure},
year = {2022},
volume = {1250},
publisher = {Elsevier},
month = {feb},
url = {https://doi.org/10.1016/j.molstruc.2021.131649},
pages = {131649},
doi = {10.1016/j.molstruc.2021.131649}
}