Synthesis, Characterization, DFT, and ...
Document type :
Article dans une revue scientifique: Article original
DOI :
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Title :
Synthesis, Characterization, DFT, and Thermogravimetric Analysis of Neutral Co(II)/Pyrazole Complex, Catalytic Activity toward Catecholase and Phenoxazinone Oxidation
Author(s) :
Boutaybi, Mohamed El [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Bouroumane, Nadia [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Azzouzi, Mohamed [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Aaddouz, Mohamed [Auteur]
Laboratoire de Chimie Appliquée et Environnement | Laboratory of Applied and Environmental Chemistry [Université Mohammed Premier Oujda] [LCAE]
Bacroume, Said [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
El Miz, Mohamed [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Touzani, Rachid [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Bahari, Zahra [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Zarrouk, Abdelkader [Auteur]
Université Mohammed V de Rabat [Agdal] [UM5]
El-Marghany, Adel [Auteur]
King Saud University [Riyadh] [KSU]
Jama, charafeddine [Auteur]
Unité Matériaux et Transformations (UMET) - UMR 8207
Abu-Rayyan, Ahmed [Auteur]
Warad, Ismail [Auteur]
An-Najah National University
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Bouroumane, Nadia [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Azzouzi, Mohamed [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Aaddouz, Mohamed [Auteur]
Laboratoire de Chimie Appliquée et Environnement | Laboratory of Applied and Environmental Chemistry [Université Mohammed Premier Oujda] [LCAE]
Bacroume, Said [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
El Miz, Mohamed [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Touzani, Rachid [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Bahari, Zahra [Auteur]
Université Mohammed Premier [Oujda] = Université Mohammed Ier
Zarrouk, Abdelkader [Auteur]
Université Mohammed V de Rabat [Agdal] [UM5]
El-Marghany, Adel [Auteur]
King Saud University [Riyadh] [KSU]
Jama, charafeddine [Auteur]
Unité Matériaux et Transformations (UMET) - UMR 8207
Abu-Rayyan, Ahmed [Auteur]
Warad, Ismail [Auteur]
An-Najah National University
Journal title :
Crystals
Abbreviated title :
Crystals
Volume number :
13
Pages :
155
Publisher :
MDPI AG
Publication date :
2023-01-17
ISSN :
2073-4352
English keyword(s) :
cobalt(II)
pyrazole
catecholase
phenoxazinone
DFT
pyrazole
catecholase
phenoxazinone
DFT
HAL domain(s) :
Chimie/Matériaux
English abstract : [en]
The pyrazole-pyridin-2-amine, as a tridentate pyrazole ligand, and its neutral Co(II)/pyrazole complex were prepared using a direct method with a high yield. The desired pyrazole ligand and its complex were subjected to ...
Show more >The pyrazole-pyridin-2-amine, as a tridentate pyrazole ligand, and its neutral Co(II)/pyrazole complex were prepared using a direct method with a high yield. The desired pyrazole ligand and its complex were subjected to several physicochemical and thermal analyses; moreover, the DFT-like optimization of MEP, HOMO/LUMO, and TD-DFT correlated well with their experimental relatives. Additionally, the oxidation catalytic activities of the Co(II)/pyrazole complex, such as the catecholase of catechol to o-quinone and the phenoxazinone of 2-aminophenol to 2-aminophenoxazinone, were also evaluated under mild RT conditions and atmospheric oxygen.Show less >
Show more >The pyrazole-pyridin-2-amine, as a tridentate pyrazole ligand, and its neutral Co(II)/pyrazole complex were prepared using a direct method with a high yield. The desired pyrazole ligand and its complex were subjected to several physicochemical and thermal analyses; moreover, the DFT-like optimization of MEP, HOMO/LUMO, and TD-DFT correlated well with their experimental relatives. Additionally, the oxidation catalytic activities of the Co(II)/pyrazole complex, such as the catecholase of catechol to o-quinone and the phenoxazinone of 2-aminophenol to 2-aminophenoxazinone, were also evaluated under mild RT conditions and atmospheric oxygen.Show less >
Language :
Anglais
Audience :
Internationale
Popular science :
Non
Administrative institution(s) :
Université de Lille
CNRS
INRAE
ENSCL
CNRS
INRAE
ENSCL
Collections :
Research team(s) :
Procédés de Recyclage et de Fonctionnalisation (PReF)
Submission date :
2023-02-08T17:25:33Z
2023-02-09T13:50:01Z
2023-02-09T13:50:01Z
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