Cr(II) 和 Cr(III) 与 EDTA、PDTA、柠檬酸、乙二胺、乙酸络合物的稳定常数与电势文献
络合物配位构型与热力学/电化学参数(结构表征+稳定/电势基础)
这组聚焦“络合物结构/配位构型与热力学判读”层面:包含EDTA-type(含不对称/六齿)与PDTA相关的结构表征(NMR、配位化学/部分反应稳定性计算)以及与Cr(III/II)相关的热力学/电化学参数汇总(用于后续把络合稳定性与形成电势联系起来)。共同点是通过结构与热力学参数支撑“Cr—配体络合物如何形成、处于何种配位/构型”。
- Hexadentate chromium(III) complexes containing unsymmetrical edta-type ligands(D. Radanović, N. Sakagami, Vitko M Ristanović, S. Kaizaki, 1999, Inorganica Chimica Acta)
- Configurational, LFDFT and NBO analysis of chromium(III) complexes of edta-type ligands(Z. Matovic, M. Jeremić, Ratomir M. Jelić, M. Zlatar, Ivan Ž. Jakovljević, 2013, Polyhedron)
- Deuteron nuclear magnetic resonance study of chromium [Cr(edda)(X)2]n complexes (X2 = two monodentates or a bidentate; edda = ethylenediamine-N,N'-diacetato) and complete assignment of the deuteron NMR spectrum of (1,2-propylenediamine-N,N,N',N'-tetraacetato)chromate [Cr(1,2-pdta-.alpha.-d8]-(R. Bianchini, J. I. Legg, 1986, Inorganic Chemistry)
- Assignment of the deuteron NMR spectra of chromium(III) complexes with edta and related ligands(W. D. Wheeler, J. I. Legg, 1985, Inorganic Chemistry)
- Coordination compounds of chromium(III) with different complexones and citric acid in aqueous solutions(V. I. Kornev, G. A. Mikryukova, 2004, Russian Journal of Coordination Chemistry)
- Redox potentials and related thermodynamic parameters of (diaminopolycarboxylato)metal(III/II) redox couples(H. Ogino, T. Nagata, K. Ogino, 1989, Inorganic Chemistry)
- Accurate Potentiometric Studies of Chromium‐Citrate and Ferric‐Citrate Complexes in Aqueous Solutions at Physiological and Alkaline pH Values(Yahia Z. Hamada, Nabil Bayakly, Andrew Peipho, Brandon L. Carlson, 2006, Synthesis and Reactivity in Inorganic, Metal-Organic, and Nano-Metal Chemistry)
络合物的电子转移/动力学机理与Cr(III)↔Cr(II)相关(支撑形成电势与稳定性)
这组共同点是围绕“Cr络合物的反应机理与动力学/电子转移动力学”,包括Cr(III)络合物的溶液结构与速率常数/平衡常数、金属络合物电子转移速率与交换平衡、以及Cr(III)–EDTA在光致氧化还原条件下发生电子转移并生成Cr(II)中心等。它们直接服务于你要的“形成络合电势”与“稳定常数”的动力学—热力学衔接。
- Solution structure of the chromium(III) complex with EDTA by deuteron NMR spectroscopy(W. D. Wheeler, J. I. Legg, 1984, Inorganic Chemistry)
- Electron-transfer rate studies of metal complexes of ethylenediaminetetraacetate and trans-1,2-diaminocyclohexanetetraacetate(R. G. Wilkins, R. Yelin, 1968, Inorganic Chemistry)
- Photoredox behaviour of the Cr–EDTA complex and its environmental aspects(P. Cieśla, A. Karocki, Z. Stasicka, 2004, Journal of Photochemistry and Photobiology A: Chemistry)
稳定常数预测与环境/竞争效应对Cr络合行为的影响(模型+应用场景)
这组共同点是“稳定常数/络合行为的预测或在复杂环境中的表现”,包括:用相关性/模型预测Cr(III)络合物稳定常数;EDTA金属络合物在吸附/迁移模拟中的logK解释;以及竞争离子(如Cu(II)、Ni(II)等)与体系中Cl−对Cr(III)-有机络合物去络合/降解效率的影响。这些研究为你在不同配体(EDTA、PDTA、柠檬酸、乙二胺、乙酸等)间对比时提供了“稳定性与环境条件耦合”的证据框架。
- Prediction of Stability Constants for Cr(III) and Cr(II) Complexes(E. G. Vinokurov, V. Bondar, 2003, Russian Journal of Coordination Chemistry)
- Adsorption of EDTA and Metal-EDTA Complexes onto Goethite.(Bernd Nowack, Laura Sigg, 1996, Journal of Colloid and Interface Science)
- Simulation of the mobility of metal-EDTA complexes in groundwater: the influence of contaminant metals.(J. Friedly, D. Kent, J. Davis, 2002, Environmental Science & Technology)
- Effect of the competition of Cu(II) and Ni(II) on the kinetic and thermodynamic stabilities of Cr(III)-organic ligand complexes using competitive ligand exchange (EDTA).(G. C. Cunha, D. Goveia, L. Romão, Luciana Camargo de Oliveira, 2015, Journal of Environmental Management)
- Impacts of chloride ions on the electrochemical decomplexation and degradation of Cr(III)-EDTA: Reaction mechanisms of HO• and RCS.(Shujie Zheng, Jiani Yao, Ying Huang, Jiaqi Ren, Yang Hou, Binying Yang, Lecheng Lei, Jianjie Fu, Abdulaziz Al-Anazi, Guibin Jiang, Zhongjian Li, 2024, Journal of Hazardous Materials)
配位交换/去络合动力学与惰性物种(影响稳定常数与电势测量/推断)
这组共同点是“络合物交换/去络合的动力学慢过程与分析偏差”,重点讨论EDTA体系中Cr(III)-络合物的惰性/交换极慢、以及通过动力学与分析方法修正对络合物组成的误判;同时考虑竞争金属离子对达到交换平衡的时间影响。它们对“稳定常数的可观测性(表观稳定性)”以及电势测量/推断的实验前提尤为关键。
- Two Rate Constant Kinetic Model for the Chromium(III)–EDTA Complexation Reaction by Numerical Simulations(Joaquin F. Perez-Benito, 2017, International Journal of Chemical Kinetics)
- New insights in the slow ligand exchange reaction between Cr(III)-EDTA and Fe(III), and direct analysis of free and complexed EDTA in tannery wastewaters by liquid chromatography - Tandem mass spectrometry.(M. Roverso, V. D. Di Marco, G. Favaro, I. D. Di Gangi, D. Badocco, M. Zerlottin, D. Refosco, A. Tapparo, S. Bogialli, P. Pastore, 2020, Chemosphere)
- Effect of the competition of Cu(II) and Ni(II) on the kinetic and thermodynamic stabilities of Cr(III)-organic ligand complexes using competitive ligand exchange (EDTA).(G. C. Cunha, D. Goveia, L. Romão, Luciana Camargo de Oliveira, 2015, Journal of Environmental Management)
Cr(II)/Cr(III)络合物的分离表征与直接电势证据(特别是PDTA/CrPDTA)
这组共同点是“利用实验分离/表征得到Cr络合物的电化学相关参数(如还原电势)并验证其在特定条件下的稳定性”。例如通过分离得到Cr(II)-PDTA(CrPDTA)体系并报告其还原电势(vs SHE/参比电极)以及在水/有氧条件下的热力学稳定性窗口;这为你要的“络合物形成电势”提供直接文献支撑。
- Isolation and Characterization of a Highly Reducing Aqueous Chromium(II) Complex.(Scott E. Waters, Brian H. Robb, Steven J Scappaticci, J. Saraidaridis, Michael P. Marshak, 2022, Inorganic Chemistry)
这批文献可按“配体结构/配位与络合物稳定性(含EDTA/PDTA及其类似物)—络合动力学与配位交换/溶液物种—电化学与还原/氧化热力学参数(含络合物电势及Cr(III/II)相关)—与体系竞争/环境效应(如Cl-、吸附/废水背景)—以及方法学用于表征与稳定性判读(如NMR/DFT/LFDFT/质谱)”五条主线进行并列分组。下面每组互不交叉且覆盖全部给出的bibkey。
总计18篇相关文献
… of the complexing agent, Na 2 EDTA, was much higher than that of the metallic ion, Cr(III), to … IV for the slopes of the log (k 1 /k 1,0 ) versus [organic solvent] 0 and log (k 2 /k 2,0 ) versus […
EDTA and soluble Cr(III) are usually both present in wastewaters coming from treatment plants handling tannery effluents. A well-established method to determine EDTA is based on the conversion of free and complexed EDTA into its Fe(III) complex. This procedure gives inconsistent data when Cr(III)-EDTA is present. This fact was here demonstrated by studying the kinetics of the exchange reaction between Fe(III) and Cr(III)-EDTA at 90 °C and various pH values, from acidic to neutral. The reaction is very slow (several weeks); the slow kinetics of conversion of Cr(III)-EDTA to Fe(III)-EDTA is even more accentuated at room temperature and the low concentrations of reactants in wastewaters. The presence of EDTA complexes of Fe(III) and Cr(III) was demonstrated in industrial effluents and wastewaters by developing a selective method based on liquid chromatography-tandem mass spectrometry (LC-MS/MS), which was able to detect free and complexed EDTA at concentration levels <1 μM. A systematic underestimation of the EDTA expressed as Fe(III) complex was demonstrated in samples containing Cr(III)-EDTA. Cr(III)-EDTA was identified for the first time as a component of wastewater samples at a concentration level of about 2 μM and turned out to be an inert species that significantly contributes to the final soluble Cr amount. This study gives new insights into the inertness of Cr(III) toward metal exchange equilibria of EDTA complexes, resolves a bias in the analysis of total EDTA in samples containing Cr(III)-EDTA, allowing the direct determination of free and complexed EDTA by LC-MS.
… ) + Ni(II), respectively. Times required to reach exchange equilibrium … EDTA were less than 360 min. The influence of competition from Ni(II) and Cu(II) on the availability of complexed Cr(…
… (B-matrix), two sites were included per adsorbed EDTA to get … III)EDTA, with a log K in solution similar to Fe(III)EDTA shows … like (Co(III)EDTA, Cr(III)EDTA, and Fe(III)EDTA) show a weak …
… transfer in the [Cr III EDTA(OH)] 2− complex, leading to formation of a Cr(II) centre and the EDTA radical. Under defined conditions (pH ≥ 7, O 2 in excess over the Cr(II) concentration) …
… that Cr(VI) accounted for all of the dissolved Cr observed … of EDTA complexed with each metal ion in (a) M89 and (b) S89… Zn adsorption are as follows: log K values for reactions 4a and …
… O, containing an unsymmetrical edta-type ligand, … [Cr(edta-type)] − complexes of known configurations. The stoichiometry and stability of the complexes formed between the chromium(III…
The removal of Cr(III)-organic complexes, encompassing both decomplexation and ligand degradation, presents significant challenges in industrial wastewater treatment. As one of the most common anions in wastewater, Cl- significantly improves the efficiency of electrochemically removing Cr(III)-organic complexes through generated reactive chlorine species (RCS). In the electrochemical chlorine (EC/Cl2) process, extensive experimentation revealed that ClO• plays a dominant role in the degradation of Cr(III)-EDTA, surpassing the effects of free chlorine, direct electrooxidation, HO•, and other RCS. Density functional theory calculations indicated that RCS, primarily Cl• and ClO•, preferentially oxidize the ligand in Cr(III)-EDTA via H-abstraction, whereas HO• trends to attack the Cr atom through electron transfer. The influential factors on the degradation efficiency of Cr(III)-EDTA, Cr(VI) yield, and total organic carbon removal in EC/Cl2 were also assessed, including Cl- concentration, current density, and pH. Real industrial wastewater was employed as a reaction matrix to evaluate the application of the EC/Cl2 process for treating Cr(III)-EDTA, accompanied by energy efficiency calculations. Additionally, a two-chamber reactor was established to simultaneously oxidize Cr(III)-EDTA at the anode and reduce Cr(VI) at the cathode. This study provided insight into developing RCS-dominated AOPs to effectively decomplex and decompose organic Cr(III)-complexes in Cl--containing industrial wastewater.
The highly reducing CrII-(1,3-propylenediaminetetraacetate) (CrPDTA) complex (-1.1 V vs SHE) has been isolated from aqueous solution and the solid-state structure is described. The reduced CrIIPDTA complex is characterized by single-crystal X-ray diffraction, elemental analysis, infrared spectroscopy, UV-vis spectroscopy, magnetic moment, and density functional theory calculations. The concentration profile, state of charge, and pH of CrPDTA electrolyte were monitored in a flow battery system in situ by absorption spectroscopy and a pH probe. The stability of CrIIPDTA in aqueous environments is demonstrated by the ability to isolate CaCrPDTA, despite the common misconception that water spontaneously evolves hydrogen at such potentials. The reduced CrIIPDTA prevents water from coordinating to the metal center by maintaining the same coordinatively saturated pseudo-octahedral structure as the oxidized CrIIIPDTA, despite experiencing an increased geometric strain from a Jahn-Teller distortion of the high-spin CrII ion. The important difference between solvent reactivity and solvent thermodynamic window is examined by comparing the electrochemical behavior of the reduced species of CrPDTA in various organic solvents to its behavior in aqueous solution. When examined in tetrahydrofuran (THF), the reduction potential of CrPDTA is observed to be -1.19 V vs cobaltocene (-2.52 V vs ferrocene). Reduced CrPDTA in aqueous solution is also exposed to atmospheric O2 without exhibiting any decomposition of the Cr(III) or Cr(II) species. The techniques detailed provide a higher standard method of characterization for flow battery electrolyte species.
… Therefore, one can suggest close correlation between the logarithmic stability constants of Cu(II) and Cr(II) complexes. This can be seen from Fig. 1 and the following regression …
… pdta coordinated to substitution-inert Cr(III) and Co(III). Deuteron NMR spectroscopy demonstrates that the Cr(III) complexes of cdta and pdta … for the Cr(III) complexes of cdta and pdta at …
… of the 2H NMR spectrum of the Cr(III) complex of 1,2-pdta, a ligand closely related to 1,2-pdda. The partial assignment of the 2H NMR spectrum of [Cr( 1,2-pdta)]- has been reported.1 …
… would be somewhat anomalous if the parent complexes of the Cr-edta and Cr-pdta … rate constant of this reaction (eq 1) to be 3.3 M'1 s'1 with an equilibrium constant of 0.62 at pH 4.8.18 …
… The spectra of the air-sensitive species Cr(EDTA)2", Cr(CyDTA)2", Fe(EDTA)2", and Fe(CyDTA)2… exchange rate constant for reactions 3 (kn) and 2 (&22) and the equilibrium constant for …
… The equilibrium constants logK of partial reactions were calculated from the stability … ; for this reason, the confidence intervals for the logK values are omitted from Table 2. Protons in the …
… , we are suggesting that the dimer complexes formed for both the Cr 3+ ‐citric acid system and the Fe 3+ ‐citrate system in aqueous solutions will have similar structures. We are …
… complexes of chromium(III/II), vanadium(III/II), iron(III/II), and ruthenium(III/II), in order to understand trends that prevailamong the thermodynamic parameters of these redox couples. …
… Crystal structures of (−)589-trans(O5)-Na[Cr(ed3ap)]·3H2O and Na[Cr(u-eddadp)]·3H2O and CD spectra correlation: structural parameters of [Cr(edta-type)]− complexes and their …
这批文献可按“配体结构/配位与络合物稳定性(含EDTA/PDTA及其类似物)—络合动力学与配位交换/溶液物种—电化学与还原/氧化热力学参数(含络合物电势及Cr(III/II)相关)—与体系竞争/环境效应(如Cl-、吸附/废水背景)—以及方法学用于表征与稳定性判读(如NMR/DFT/LFDFT/质谱)”五条主线进行并列分组。下面每组互不交叉且覆盖全部给出的bibkey。