More of a misunderstanding than a real mismatch? Platinum and its affinity for aqua, hydroxido, and oxido ligands

B Lippert, PJS Miguel - Coordination Chemistry Reviews, 2016 - Elsevier
This article reviews discrete complexes of platinum in its common oxidation states+ II,+ III,
and+ IV with aqua, hydroxido, oxido, and peroxido ligands, which at some point had been …

Chemical structure and reactivity by means of quantum chemical topology analysis

J Andres, L Gracia, P Gonzalez-Navarrete… - Computational and …, 2015 - Elsevier
Chemical structure and bonding are key features and concepts in chemical systems which
are used in deriving structure–property relationships, and hence in predicting physical and …

Synthesis, characterization, and computational study of complexes containing Pt··· H hydrogen bonding interactions

M Baya, Ú Belío, A Martín - Inorganic Chemistry, 2014 - ACS Publications
Complexes [Pt (C6F5)(bzq) L](bzq= 7, 8-benzoquinolinate; L= 8-hydroxyquinoline, hqH (1);
2-methyl-8-hydroxyquinoline, hqH′(2)) have been prepared by replacing the labile acetone …

Estimation of transition-metal empirical parameters for molecular mechanical force fields

F Sebesta, V Sláma, J Melcr, Z Futera… - Journal of chemical …, 2016 - ACS Publications
Force-field parameters of the first row transition metals together with a few additional
common elements such as those from the second (Rh, Ru) and third (Hg, Pt) rows of …

Agostic and Hydrogen-Bonding X–H…M Interactions Involving ad8 Metal Center: Recent Advances Towards Their Understanding

J Kozelka - Noncovalent forces, 2015 - Springer
The binding of d 8 transition metal ions to X–H bonds (X= non-metal) has been subject of
intense research in the last two decades. Two different types of orbital interactions can …

Cisplatin binding to biological ligands revealed at the encounter complex level by IR action spectroscopy

D Corinti, C Coletti, N Re, B Chiavarino… - … A European Journal, 2016 - Wiley Online Library
Abstract Cisplatin [cis‐diamminedichloroplatinum (II)] was the first platinum‐based
antineoplastic agent and is still a cornerstone for the treatment of various solid tumors …

Preparing gold (I) for interactions with proton donors: The elusive [Au]⋅⋅⋅ HO hydrogen bond

F Groenewald, J Dillen… - Angewandte Chemie …, 2016 - Wiley Online Library
MP2 and DFT calculations with correlation consistent basis sets indicate that isolated linear
anionic dialkylgold (I) complexes form moderately strong (ca. 10 kcal mol− 1) Au⋅⋅⋅ H …

Unraveling the Hydration Shell Structure and Dynamics of Group 10 Aqua Ions

X Chen, A Cifuentes-Lopez, X Shao, L Lin… - The Journal of …, 2024 - ACS Publications
We present ab initio simulations based on subsystem DFT of group 10 aqua ions accurately
compared against experimental data on hydration structure. Our simulations provide insights …

[HTML][HTML] Short-lived intermediates (encounter complexes) in cisplatin ligand exchange elucidated by infrared ion spectroscopy

D Corinti, C Coletti, N Re, R Paciotti, P Maître… - International Journal of …, 2019 - Elsevier
Abstract Cisplatin (cis-diamminedichloroplatinum (II), cis-[PtCl 2 (NH 3) 2]), widely used drug
in cancer treatment, has been allowed to react with simple molecular targets (L) mimicking …

On the nature of hydrogen bonds to platinum (II)–which interaction can predict their strength?

R Sánchez-de-Armas, MSG Ahlquist - Physical Chemistry Chemical …, 2015 - pubs.rsc.org
The interaction between hydrogen bond donors and platinum has been analysed. Our
results point to an interaction that can be entirely predicted from the dz2 orbital energy of the …