Pure and Applied Chemistry

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• Tiwari Surya Prakash, Rai Neeraj, Maginn Edward J.: Dynamics of actinyl ions in water: a molecular dynamics simulation study. Phys. Chem. Chem. Phys. 2014, 16, 8060. <http://dx.doi.org/10.1039/c3cp54556c>
• Petković B.B., Milčić M., Stanković D., Stambolić I., Manojlović D., Jovanović V.M., Sovilj S.P.: Complexation ability of octaazamacrocyclic ligand toward Co2+, Ni2+, Cu2+ and Zn2+ metal cations: Experimental and theoretical study. Electrochimica Acta 2013, 89, 680. <http://dx.doi.org/10.1016/j.electacta.2012.11.100>
• Sato Takeshi, Ebara Mitsuhiro, Tanaka Shinji, Asoh Taka-Aki, Kikuchi Akihiko, Aoyagi Takao: Rapid self-healable poly(ethylene glycol) hydrogels formed by selective metal–phosphate interactions. Phys. Chem. Chem. Phys. 2013, 15, 10628. <http://dx.doi.org/10.1039/c3cp50165e>
• Handley Christopher M., Deeth Robert J.: A Multi-Objective Approach to Force Field Optimization: Structures and Spin State Energetics of d⁶ Fe(II) Complexes. J Chem Theory and Comput 2012, 8, 194. <http://dx.doi.org/10.1021/ct200584a>
• Kashinath Dhurke, Tisserand Steve, Puli Narender, Falck John R., Baati Rachid: Generation of Nucleophilic Chromium Acetylides from gem-Trichloroalkanes and Chromium Chloride: Synthesis of Propargyl Alcohols. Eur J Org Chem 2010, 2010, 1869. <http://dx.doi.org/10.1002/ejoc.200901476>
• Deeth Robert J., Anastasi Anna E., Wilcockson Martin J.: An In Silico Design Tool for Fe(II) Spin Crossover and Light-Induced Excited Spin State-Trapped Complexes. J Am Chem Soc 2010, 132, 6876. <http://dx.doi.org/10.1021/ja1007323>
• Wasada Hiroaki, Wasada-Tsutsui Yuko, Hashimoto Tomohiro, Funahashi Shigenobu: Theoretical study of acetonitrile-exchange reactions on hexasolvated divalent cations in the first transition series elements. Int J Quantum Chem 2009, 109, 2208. <http://dx.doi.org/10.1002/qua.22112>
• Benito-López Fernando, Egberink Richard J.M., Reinhoudt David N., Verboom Willem: High pressure in organic chemistry on the way to miniaturization. Tetrahedron 2008, 64, 10023. <http://dx.doi.org/10.1016/j.tet.2008.07.108>
• Lincoln Stephen F.: Mechanistic Studies of Metal Aqua Ions: A Semi-Historical Perspective. HCA 2005, 88, 523. <http://dx.doi.org/10.1002/hlca.200590036>
• Wasada-Tsutsui Yuko, Wasada Hiroaki, Funahashi Shigenobu: Theoretical Study of Solvent-Exchange Reactions on Hexasolvated Divalent Cations in the First Transition Series: Model Calculation of a Hydrogen Cyanide Exchange. Bull Chem Soc Jpn 2003, 76, 1713. <http://dx.doi.org/10.1246/bcsj.76.1713>
• Schwenk Christian F, Loeffler Hannes H, Rode Bernd M: Dynamics of the solvation process of Ca2+ in water. chem phys letts 2001, 349, 99. <http://dx.doi.org/10.1016/S0009-2614(01)01188-5>
• Swaddle Thomas W., Tregloan Peter A.: Electrode reactions of metal complexes in solution at high pressures. Coord Chem Rev - 1999, 187, 255. <http://dx.doi.org/10.1016/S0010-8545(99)00007-7>
• Stochel Grazyna, Eldik Rudi van: Elucidation of inorganic reaction mechanisms through volume profile analysis. Coord Chem Rev - 1999, 187, 329. <http://dx.doi.org/10.1016/S0010-8545(99)00009-0>
• Helm L., Merbach A.E.: Water exchange on metal ions: experiments and simulations. Coord Chem Rev - 1999, 187, 151. <http://dx.doi.org/10.1016/S0010-8545(99)90232-1>
• Kim Jung-Sung, Matsuda Takaaki, Harada Masayuki, Kim Seong-Yun, Park Yoon-Yul, Tomiyasu Hiroshi, Ikeda Yasuhisa: High pressure NMR studies on ligand exchange reactions in the equatorial sites of [VO(L)5]2+ (L=acetonitrile, N,N-dimethylformamide, and N,N-dimethylacetamide). Inorg Chim Ada 1999, 294, 119. <http://dx.doi.org/10.1016/S0020-1693(99)00283-2>
• Tsutsui Yuko, Wasada Hiroaki, Funahashi Shigenobu: Reaction mechanism of water exchange on di- and trivalent cations of the first transition series and structural stability of seven-coordinate species. Journal of Molecular Structure: THEOCHEM 1999, 461-462, 379. <http://dx.doi.org/10.1016/S0166-1280(98)00451-5>
• Romero José M., Verdú Jesús, Blanco Carlos A.: Thermodynamic analysis of 1,3-dicarbonylic monochelates of iron(III) from equilibrium and kinetic measurements. Int J Chem Kinet 1998, 30, 121. <http://dx.doi.org/10.1002/(SICI)1097-4601(1998)30:2<121::AID-KIN3>3.0.CO;2-U>
• Tsutsui Yuko, Wasada Hiroaki, Funahashi Shigenobu: The Structural Stability of Seven-Coordinate Divalent Cations in the First Transition Series Relevant to the Water-Exchange Reaction Mechanism. Bull Chem Soc Jpn 1998, 71, 1771. <http://dx.doi.org/10.1246/bcsj.71.1771>
• Tsutsui Yuko, Wasada Hiroaki, Funahashi Shigenobu: The Stability of Seven-Coordinate Species of Earlier Members in the First Transition Series: Heptahydrated Ti(II), V(II), Cr(II), and Mn(II) Ions Relevant to Intermediate and Transition State in Water-Exchange Reaction. Bull Chem Soc Jpn 1998, 71, 73. <http://dx.doi.org/10.1246/bcsj.71.73>
• Phillips Brian L., Casey William H., Crawford Susan Neugebauer: Solvent exchange in AlFx (H2O 6−x3−x (aq) complexes: Ligand-directed labilization of water as an analogue for ligand-induced dissolution of oxide minerals. Geochimica et Cosmochimica Acta 1997, 61, 3041. <http://dx.doi.org/10.1016/S0016-7037(97)00149-X>
• Tsutsui Yuko, Wasada Hiroaki, Funahashi Shigenobu: Theoretical Study of Water-Exchange Reactions of Hexahydrated Divalent Cations in the First Transition Series: Relationship between Reaction Mechanism and Stability of Heptacoordinated Species. Bull Chem Soc Jpn 1997, 70, 1813. <http://dx.doi.org/10.1246/bcsj.70.1813>
• Boča Roman, Elias Horst: Lability of the metal-water bond in pentamethylcyclopentadienyl bipyridine aqua complexes of cobalt, rhodium and iridium: A molecular orbital study. J Polyhedron 1996, 15, 2425. <http://dx.doi.org/10.1016/0277-5387(95)00507-2>
• Wen-Fu Fu, van Eldik Rudi: Photo-substitution reactions of Cr(CO)4(1,10-phenanthroline). Mechanistic information from entering nucleophile, irradiation wavelength and pressure dependences. Inorg Chim Ada 1996, 251, 341. <http://dx.doi.org/10.1016/S0020-1693(96)05288-7>
• Yoshida Hiroto, Ozawa Tomohiro, Jitsukawa Koichiro, Einaga Hisahiko: Kinetics and mechanism of complex formation reaction of iron(II) with 4-methyl-8-DI(Carboxymethyl)aminomethyl umbelliferrone: Role of the fourth chelating group in tripodal (NO3)-type tetradentate ligand structure on the stabilization of the iron(II) complex. J Polyhedron 1995, 14, 997. <http://dx.doi.org/10.1016/0277-5387(94)00352-F>
• Sado Masashi, Ozawa Tomohiro, Jitsukawa Koichiro, Einaga Hisahiko: Selectivity in coordination of 7-substituted-8-hydroxy-5-quinolinesulphonates to aluminium(III). J Polyhedron 1995, 14, 2985. <http://dx.doi.org/10.1016/0277-5387(95)00119-D>
• Hubbard Colin D., van Eldik Rudi: Use of High Pressure Techniques For Measuring Reaction Rates in Liquid Solutions. Instr Sci Technol 1995, 23, 1. <http://dx.doi.org/10.1080/10739149508011694>
• Hazama Ryoichi, Umakoshi Keisuke, Ichimura Akio, Ikari Shinji, Sasaki Yoichi, Ito Tasuku: Dinuclear Oxomolybdenum(V) and Oxotungsten(V) Complexes of the Hexadentate Ligands N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine and Its Propylenediamine Analog. Bull Chem Soc Jpn 1995, 68, 456. <http://dx.doi.org/10.1246/bcsj.68.456>
• Buckingham D.A.: The linkage isomerism of thiocyanate bonded to cobalt (III). Coord Chem Rev - 1994, 135-136, 587. <http://dx.doi.org/10.1016/0010-8545(94)80078-2>
• Lang E.W., Lüdemann H.-D.: Density dependence of rotational and translational molecular dynamics in liquids studied by high pressure NMR. Progr Nucl Magn Reson Spectrosc 1993, 25, 507. <http://dx.doi.org/10.1016/0079-6565(93)80007-G>
• Pittet Pierre-André, Dadci Lynda, Zbinden Pascal, Abou-Hamdan Amira, Merbach André E.: High-pressure proton NMR study of acetonitrile exchange kinetics on [Rh2(CH3CN)10]4+ and 17O NMR investigation of aqueous solutions of [Rh2(H2O)10]4 +. Inorg Chim Ada 1993, 206, 135. <http://dx.doi.org/10.1016/S0020-1693(00)82859-5>
• Dey Benu, Coates John H., Duckworth Paul A., Lincoln Stephen F., Wainwright Kevin P.: Complexation of cobalt(II), nickel(II) and copper(II) by the pendant arm macrocyclic ligand N,N′,N″,N‴-tetrakis(2-hydroxyethyl)-l,4,8,11-tetraazacyclotetradecane. Inorg Chim Ada 1993, 214, 77. <http://dx.doi.org/10.1016/S0020-1693(00)87528-3>
• Abou-Hamdan A., Burki N., Lincoln S.F., Merbach A.E., Vincent S.J.F.: Variable-pressure 1H NMR studies of hexamethylphosphoramide and trimethyl phosphate exchange on dioxouranium(VI). Inorg Chim Ada 1993, 207, 27. <http://dx.doi.org/10.1016/S0020-1693(00)91452-X>
• Sasaki Yoichi, Nagasawa Akira, Tokiwa-Yamamoto Ayako, Ito Tasuko: Substitution of methanol-d4 for the coordinated water in the trinuclear complexes, [M3(μ3-O)(μ-CH3COO)6(H2O)3]+ (M3=Ru3, Rh3 or Ru2Rh) in methanol-d4. Inorg Chim Ada 1993, 212, 175. <http://dx.doi.org/10.1016/S0020-1693(00)92323-5>
• Yoshida Hiroto, Ozawa Tomohiro, Jitsukawa Koichiro, Einaga Hisahiko: Kinetics and mechanism of complex formation reaction of iron(III) with 4-methyl-8-(carboxymetahyl_aminomethyl umbelliferrone and related ligands: role of substituent groups on nitrogen donor atoms on the reaction. J Polyhedron 1993, 12, 1319. <http://dx.doi.org/10.1016/S0277-5387(00)84322-3>
• Blanco Carlos A., Hernando José M., Mateo Manuel: Mono-complex formation kinetics of 2-acetylcyclohexanonatochromium(III) in aqueous solution. Int J Chem Kinet 1992, 24, 533. <http://dx.doi.org/10.1002/kin.550240603>
• Stochel Graż;yna: High-pressure mechanistic studies on thermal and photochemical reactions of pentacyanoferrate complexes. Coord Chem Rev - 1992, 114, 269. <http://dx.doi.org/10.1016/0010-8545(92)85005-B>
• Rizkalla Emil N., Choppin Gregory R.: Hydration of lanthanides and actinides in solution. J Alloys Comp 1992, 180, 325. <http://dx.doi.org/10.1016/0925-8388(92)90398-S>
• Laurenczy Gábor, Bugnon Pascal, Merbach André E.: Monocomplex formation and dissociation of some first row divalent transition metal ions with 2-chloro-1,10-phenanthroline by the high-pressure stopped-flow technique. Inorg Chim Ada 1992, 198-200, 159. <http://dx.doi.org/10.1016/S0020-1693(00)92357-0>
• Van Eldik Rudi, Merbach André E.: High Pressure Kinetics. A Decisive Dimension in Mechanistic Studies of Inorganic Reactions. Comments Inorg Chem 1992, 12, 341. <http://dx.doi.org/10.1080/02603599208055169>
• Laurenczy Gábor, Rapaport Irina, Zbinden Donald, Merbach André E.: Variable-pressure oxygen-17 NMR study of water exchange on hexaaquarhodium(III). Magn Reson Chem 1991, 29, S45. <http://dx.doi.org/10.1002/mrc.1260291311>
• Lay Peter A.: Recent developments on the mechanisms of substitution reactions of octahedral coordination complexes. Coord Chem Rev - 1991, 110, 213. <http://dx.doi.org/10.1016/0010-8545(91)80006-Y>
• Lay Peter A.: New Insights into the Mechanisms of Spontaneous and Base-Catalysed Substitution Reactions of the Inert Metal Amine Complexes. Comments Inorg Chem 1991, 11, 235. <http://dx.doi.org/10.1080/02603599108035828>
• Swaddle T. W.: On the Mechanism of Octahedral Substitution. Comments Inorg Chem 1991, 12, 237. <http://dx.doi.org/10.1080/02603599108053476>
• Furrer P., Fey U., Helm L., Merbach A. E.: Dimethyl formamide exchange on hexakis (dimethyl formamide)-magnesium (II): A¹H NMR high-pressure study. High Pressure Science and Technology 1991, 7, 144. <http://dx.doi.org/10.1080/08957959108245530>
• Frey Urban, Helm Lothar, Merbach Andréa E.: High-pressure, high-resolution NMR probe working at 400 MHZ. High Pressure Science and Technology 1990, 2, 237. <http://dx.doi.org/10.1080/08957959008203174>
• Frey Urban, Merbach Andre E.: Chemical kinetics at high pressure. High Pressure Science and Technology 1990, 5, 628. <http://dx.doi.org/10.1080/08957959008246209>
• Hellquist B., Elding L. I., Merbach A. E., Ducommun Y., Helm L., Van Eldik R.: Solvent exchange and complex formation reactions of Pd(II) in aqueous solution: mechanistic information from high pressure studies. High Pressure Science and Technology 1990, 5, 672. <http://dx.doi.org/10.1080/08957959008246223>
• Sauvageat Pierre-Yves, Ducommun Yves, Merbach André E.: Variable-Temperature and Variable-Pressure Kinetic and Equilibrium studies of formation and dissociation of [V(H2O)5NCS]2+. HCA 1989, 72, 1801. <http://dx.doi.org/10.1002/hlca.19890720816>
• Kotowski M., van Eldik R.: Application of high pressure kinetic techniques to mechanistic studies in coordination chemistry. Coord Chem Rev - 1989, 93, 19. <http://dx.doi.org/10.1016/0010-8545(89)80011-6>
• Helm L., Merbach A. E., Kotowski M., Eldik R. Van: High pressure ¹⁷O NMR study of solvent exchange on square planar complexes: Water exchange on [Pd(dien)H₂O]²⁺. High Pressure Science and Technology 1989, 2, 49. <http://dx.doi.org/10.1080/08957958908201031>
• Ioset Jacques, Helm Lothar, Merbach André, Roulet Raymond, Grepioni Fabrizia, Braga Dario: Intramolecular Dynamics of Five-coordinate iron Carbonyl Complexes with olefinic ligands as studied by variable-pressure1H-NMR spectroscopy. HCA 1988, 71, 1458. <http://dx.doi.org/10.1002/hlca.19880710609>
• Laurenezy Gabor, Merbach André E.: The Reaction Volume for the Equilibrium between the Lanthanide (III) ennea- and octaaqua lons as a diagnostic aid for their water-exchange mechanisms. Preliminary Communication. HCA 1988, 71, 1971. <http://dx.doi.org/10.1002/hlca.19880710815>
• Crumbliss Alvin L., Garrison J. Mark: A Comparison of Some Aspects of the Aqueous Coordination Chemistry of Aluminum(III) and Iron(III). Comments Inorg Chem 1988, 8, 1. <http://dx.doi.org/10.1080/02603598808048670>
• Cossy Cédric, Helm Lothar, Merbach André E.: Dimethylformamide-Exchange Mechanism on Some First-Row Divalent Transition-Metal Ions. HCA 1987, 70, 1516. <http://dx.doi.org/10.1002/hlca.19870700608>
• Cossy Cédric, Helm Lothar, Merbach Andre E.: Water exchange kinetics on lanthanide(III) ions: a variable temperature and pressure 17O NMR study. Inorg Chim Ada 1987, 139, 147. <http://dx.doi.org/10.1016/S0020-1693(00)84062-1>
• Helm L., Ammann C., Merbach A. E.: The Mechanism of Solvent Exchange on the Hexakis(trimethylphosphate)scandium(III) Ion. A Variable Temperature and Variable Pressure Scandium-45 NMR Study [1]. Zeitschrift fur Physikalische Chemie 1987, 155, 145. <http://dx.doi.org/10.1524/zpch.1987.155.Part_1_2.145>