Jorge Guzmán-Rasillo , Adrián Ochoa-Terán , Eduardo A. López-Maldonado , Sergio Pérez-Sicairos , Balter Trujillo-Navarrete , Luis Miguel López-Martínez , José García-Elías , Paul A. Sandoval-Hernandez , Marisela Martínez Quiroz
{"title":"Carboxyl-functionalized bis(carbamoylcarboxylic) acid ligands as a novel alternative for hazardous metal ions removal by coagulation-flocculation","authors":"Jorge Guzmán-Rasillo , Adrián Ochoa-Terán , Eduardo A. López-Maldonado , Sergio Pérez-Sicairos , Balter Trujillo-Navarrete , Luis Miguel López-Martínez , José García-Elías , Paul A. Sandoval-Hernandez , Marisela Martínez Quiroz","doi":"10.1016/j.molstruc.2025.142107","DOIUrl":null,"url":null,"abstract":"<div><div>In this work, a new series of carboxyl-functionalized bis(carbamoylcarboxylic) acid ligands (<em>bCCAs</em>) was synthesized to evaluate their performance as coagulant-flocculant agents. The interaction of these ligands with metal ions was evaluated in solution by UV-Vis spectroscopy in organic media finding 1:2 and 1:1 (metal:ligand) complexes. Zeta potential (pZ) analysis demonstrate the negative charge of these ligands at low pH, as well as the charge neutrality adding metal ions reaching the isoelectric point (IEP) due to the complexation in aqueous media. The <em>Log K<sub>a</sub></em> values (2.517 to 3.887) indicate a strong metal-ligand interaction in water. These new <em>bCCAs</em> demonstrate outstanding performance in the simultaneous removal of metal ions such as Ca<sup>2+</sup>, Cd<sup>2+</sup>, Cu<sup>2+</sup>, Ni<sup>2+</sup>, Pb<sup>2+</sup> and Zn<sup>2+</sup>, acting as both coagulant and flocculants in a coagulation-flocculation process, and showing excellent removal capacities (308 to 533 mg M<sup>n+</sup>/g of L or 1.94 to 3.68 mol M<sup>n+</sup>/mol of L), clarification kinetics (48.6 to 136.8 T%/h) and sedimentation ratios (96 to 156 mm/h). Comparing with the <em>bCCAs</em> type ligands previously studied, these carboxyl-functionalized analogues perform the fastest coagulation-flocculation process. These results indicate a high potential for effectively removing metal ions from industrial wastewater.</div></div>","PeriodicalId":16414,"journal":{"name":"Journal of Molecular Structure","volume":"1336 ","pages":"Article 142107"},"PeriodicalIF":4.0000,"publicationDate":"2025-03-18","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Molecular Structure","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0022286025007926","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
Abstract
In this work, a new series of carboxyl-functionalized bis(carbamoylcarboxylic) acid ligands (bCCAs) was synthesized to evaluate their performance as coagulant-flocculant agents. The interaction of these ligands with metal ions was evaluated in solution by UV-Vis spectroscopy in organic media finding 1:2 and 1:1 (metal:ligand) complexes. Zeta potential (pZ) analysis demonstrate the negative charge of these ligands at low pH, as well as the charge neutrality adding metal ions reaching the isoelectric point (IEP) due to the complexation in aqueous media. The Log Ka values (2.517 to 3.887) indicate a strong metal-ligand interaction in water. These new bCCAs demonstrate outstanding performance in the simultaneous removal of metal ions such as Ca2+, Cd2+, Cu2+, Ni2+, Pb2+ and Zn2+, acting as both coagulant and flocculants in a coagulation-flocculation process, and showing excellent removal capacities (308 to 533 mg Mn+/g of L or 1.94 to 3.68 mol Mn+/mol of L), clarification kinetics (48.6 to 136.8 T%/h) and sedimentation ratios (96 to 156 mm/h). Comparing with the bCCAs type ligands previously studied, these carboxyl-functionalized analogues perform the fastest coagulation-flocculation process. These results indicate a high potential for effectively removing metal ions from industrial wastewater.
期刊介绍:
The Journal of Molecular Structure is dedicated to the publication of full-length articles and review papers, providing important new structural information on all types of chemical species including:
• Stable and unstable molecules in all types of environments (vapour, molecular beam, liquid, solution, liquid crystal, solid state, matrix-isolated, surface-absorbed etc.)
• Chemical intermediates
• Molecules in excited states
• Biological molecules
• Polymers.
The methods used may include any combination of spectroscopic and non-spectroscopic techniques, for example:
• Infrared spectroscopy (mid, far, near)
• Raman spectroscopy and non-linear Raman methods (CARS, etc.)
• Electronic absorption spectroscopy
• Optical rotatory dispersion and circular dichroism
• Fluorescence and phosphorescence techniques
• Electron spectroscopies (PES, XPS), EXAFS, etc.
• Microwave spectroscopy
• Electron diffraction
• NMR and ESR spectroscopies
• Mössbauer spectroscopy
• X-ray crystallography
• Charge Density Analyses
• Computational Studies (supplementing experimental methods)
We encourage publications combining theoretical and experimental approaches. The structural insights gained by the studies should be correlated with the properties, activity and/ or reactivity of the molecule under investigation and the relevance of this molecule and its implications should be discussed.