On the Highest Oxidation States of Metal Elements in MO4 Molecules (M = Fe, Ru, Os, Hs, Sm, and Pu)

W Huang, WH Xu, WHE Schwarz, J Li - Inorganic Chemistry, 2016 - ACS Publications
Metal tetraoxygen molecules (MO4, M= Fe, Ru, Os, Hs, Sm, Pu) of all metal atoms M with
eight valence electrons are theoretically studied using density functional and correlated …

Polyfluorides and Neat Fluorine as Host Material in Matrix‐Isolation Experiments

F Brosi, T Vent‐Schmidt, S Kieninger… - … A European Journal, 2015 - Wiley Online Library
The use of neat fluorine in matrix isolation is reported, as well as the formation of
polyfluoride monoanions under cryogenic conditions. Purification procedures and …

Xenon in Rigid Oxide Frameworks: Structure, Bonding and Explosive Properties of Layered Perovskite K4Xe3O12

SN Britvin, SA Kashtanov, SV Krivovichev… - Journal of the …, 2016 - ACS Publications
The tendency of high-valence xenon to form consolidated oxide structures is herein
supported by the study of K4Xe3O12, the first example of a layered xenon perovskite. Xenon …

A new database and benchmark of the bond energies of noble‐gas‐containing molecules

CC Tsai, ZY Tsai, MY Tseng… - International Journal of …, 2020 - Wiley Online Library
We have developed a new database of structures and bond energies of 59 noble‐gas‐
containing molecules. The structures were calculated by CCSD (T)/aug‐cc‐pVTZ methods …

[XeOXeOXe]2+, the Missing Oxide of Xenon(II); Synthesis, Raman Spectrum, and X-ray Crystal Structure of [XeOXeOXe][μ-F(ReO2F3)2]2

MV Ivanova, HPA Mercier… - Journal of the American …, 2015 - ACS Publications
The [XeOXeOXe] 2+ cation provides an unprecedented example of a xenon (II) oxide and a
noble-gas oxocation as well as a rare example of a noble-gas dication. The [XeOXeOXe] 2+ …

The inert pair effect on heavy noble gases: insights from radon tetroxide

NAG Bandeira, J Marçalo - Physical Chemistry Chemical Physics, 2023 - pubs.rsc.org
A quantum chemical survey of radon and xenon tetroxides (NgO4, Ng= Xe, Rn) is reported
herein. The intermediate species, which are formed in their explosive decomposition back to …

Theoretical study of multi-coordinated Xe (AuF) n (n= 2–4): Intriguing bond-bending isomerism

D Luo, Q Yuan, L Cheng - Chemical Physics, 2023 - Elsevier
This work theoretically investigates the novel family of multi-coordinated noble gas (Ng)
complexes Xe (AuF) n (n= 2–4). Geometrical optimization at the LC-ωPBE-D3/def2TZVPP …

Synthesis and Characterization of [XeOXe]2+ in the Adduct‐Cation Salt, [CH3CN‐ ‐ ‐XeOXe‐ ‐ ‐NCCH3][AsF6]2

JR De Backere, MR Bortolus… - Angewandte Chemie …, 2016 - Wiley Online Library
Abstract Acetonitrile and [FXeOXe‐‐‐FXeF][AsF6] react at− 60° C in anhydrous HF (aHF) to
form the CH3CN adduct of the previously unknown [XeOXe] 2+ cation. The low‐temperature …

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F Grandinetti - Wiley Online Library
The elements of group 18 (the noble gases) are, generally, perceived as only less reactive.
Only krypton and xenon form, in fact, isolable compounds (the radioactive and short-lived …

Anorganische Molekülchemie

T Böttcher, R Kretschmer - Nachrichten aus der Chemie, 2016 - Wiley Online Library
Abstract Hauptgruppenelemente: Carbonylverbindungen eines p‐Blockelements, ein
Lewispaar, in dem Phosphor gleich doppelt frustriert ist, die erste Kristallstruktur eines …