Mechanistic insight on the water exchange mechanism of [Zn(tren)H2O]2+ and related complexes from a DFT study

Authors: Alzoubi, Basam M., Ćoćić, Dušan, Puchta, Ralph, Van Eldik, Rudi

Source: Journal of coordination chemistry. 75(5-6):573-586

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100155970903.0x000001&indx=1&recIds=ETOCvdc_100155970903.0x000001

Interactions of zinc(II) complexes with 5′-GMP and their cytotoxic activity

Authors: Soldatović, Tanja V., Selimović, Enisa, Šmit, Biljana, Ašanin, Darko, Planojević, Nevena S., Marković, Snežana D., Puchta, Ralph, Alzoubi, Basam M.

Source: Journal of coordination chemistry. 72(4):690-706

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100080302015.0x000001&indx=1&recIds=ETOCvdc_100080302015.0x000001

Host-guest complexes of a cryptand based on 5H-cyclopenta[2,1-b:3,4b′]pyridine moieties: prediction of ion selectivity by quantum chemical calculations XVI.

Authors: Capponi, Thomas, Weigel, Julia, Ćoćić, Dušan, Alzoubi, Basam M., Van Eldik, Rudi, Puchta, Ralph

Source: Journal of Coordination Chemistry; Apr2024, Vol. 77 Issue 7/8, p843-854, 12p

Subject Terms: ALKALINE earth ions, CRYPTANDS, COMPUTATIONAL chemistry, PYRIDINE, MOIETIES (Chemistry), IONS

Mechanistic insight on the water exchange mechanism of [Zn(tren)H2O]²⁺ and related complexes from a DFT study.

Authors: Alzoubi, Basam M.^1,2 (AUTHOR), Ćoćić, Dušan³ (AUTHOR), Puchta, Ralph^1,4,5 (AUTHOR), Van Eldik, Rudi^1,6 (AUTHOR)

Source: Journal of Coordination Chemistry. Mar2022, Vol. 75 Issue 5/6, p573-586. 14p.

Subject Terms: *DENSITY functional theory, *PHOSPHINE

HCN exchange on [Cu(HCN)4]+: a quantum chemical investigation

Authors: Alzoubi, Basam M., Weber, Immo, Walther, Markus, van Eikema Hommes, Nico, Puchta, Ralph, van Eldik, Rudi

Source: Journal of coordination chemistry. 67(13):2185-2194

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100035350188.0x000001&indx=1&recIds=ETOCvdc_100035350188.0x000001

Structural study of 2-pyridine-derived N(4)-p-tolyl thiosemicarbazone zinc(II) complexes–DFT analysis

Authors: Puchta, Ralph, Shaban, Shaban Y., Mansour, Hanaa, Alzoubi, Basam M.

Source: Journal of coordination chemistry. 63(14/16):2879-2887

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100110016636.0x000001&indx=1&recIds=ETOCvdc_100110016636.0x000001

Mechanistic Elucidation of the Substitution Behavior of Alkyl Cobaloximes in Water and Methanol as Solvents.

Authors: Alzoubi, Basam M., Liehr, Günter, Eldik, Rudi van

Source: Inorganic Chemistry; September 20 2004, Vol. 43 Issue 19, p6093-6100, 8p

HCN exchange on [Cu(HCN)4]⁺: a quantum chemical investigation.

Authors: Alzoubi, Basam M.^1,2 (AUTHOR), Weber, Immo¹ (AUTHOR), Walther, Markus³ (AUTHOR), van Eikema Hommes, Nico³ (AUTHOR), Puchta, Ralph^1,3 (AUTHOR) Ralph.Puchta@fau.de, van Eldik, Rudi¹ (AUTHOR)

Source: Journal of Coordination Chemistry. Jul2014, Vol. 67 Issue 13, p2185-2194. 10p. 2 Diagrams, 2 Charts, 3 Graphs.

Subject Terms: *EXCHANGE, *STATE bonds, *SUBSTITUTION reactions

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HCN exchange on [Cu(HCN) 4 ] : a quantum chemical investigation.

Authors: Alzoubi, Basam M., Weber, Immo, Walther, Markus, van Eikema Hommes, Nico, Puchta, Ralph, van Eldik, Rudi

Source: Journal of Coordination Chemistry; Jul2014, Vol. 67 Issue 13, p2185-2194, 10p, 2 Diagrams, 2 Charts, 2 Graphs

Subject Terms: QUANTUM chemistry, COPPER compounds, DENSITY functional theory, POLARIZATION (Electricity), COMPUTATIONAL chemistry, COMPARATIVE studies