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Journal of Computational Chemistry|August 27, 2010
Modeling environmental effects on charge density distributions in polar organometallics: validation of embedded cluster models for the methyl lithium crystalKathrin Götz, Florian Meier, Carlo Gatti, et al.Journal of the American Chemical Society|September 24, 2013
From bis(silylene) and bis(germylene) pincer-type nickel(II) complexes to isolable intermediates of the nickel-catalyzed Sonogashira cross-coupling reactionDaniel Gallego, Andreas Brück, Elisabeth Irran, et al.The Journal of Chemical Physics|March 19, 2008
A fully relativistic method for calculation of nuclear magnetic shielding tensors with a restricted magnetically balanced basis in the framework of the matrix Dirac-Kohn-Sham equationStanislav Komorovský, Michal Repiský, Olga L Malkina, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|February 19, 2022
Investigation of Molecular Iridium Fluorides IrFn (n=1-6): A Combined Matrix-Isolation and Quantum-Chemical StudyYan Lu, Yetsedaw A Tsegaw, Artur Wodyński, et al.RSC Chemical Biology|August 30, 2021
Orthogonal coiled coils enable rapid covalent labelling of two distinct membrane proteins with peptide nucleic acid barcodesGeorgina C Gavins, Katharina Gröger, Marc Reimann, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|June 1, 2022
The Use of Bridging Ligand Substituents to Bias the Population of Localized and Delocalized Mixed-Valence Conformers in SolutionParvin Safari, Simon Gückel, Josef B G Gluyas, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|December 21, 2012
A heterobimetallic approach to stabilize the elusive disulfur radical trianion ("subsulfide") S2(·3-)Shenglai Yao, Peter Hrobárik, Florian Meier, et al.Dalton Transactions (Cambridge, England : 2003)|October 22, 2015
Controlled ligand distortion and its consequences for structure, symmetry, conformation and spin-state preferences of iron(II) complexesNicole Kroll, Kolja Theilacker, Marc Schoknecht, et al.Dalton Transactions (Cambridge, England : 2003)|February 14, 2006
New route to 1-thia-closo-dodecaborane(11), closo-1-SB11H11, and its halogenation reactions. The effect of the halogen on the dipole moments and the NMR spectra and the importance of spin-orbit coupling for the 11B chemical shiftsJan Machácek, Jaromír Plesek, Josef Holub, et al.The Journal of Physical Chemistry. A|November 7, 2025
The UV Photodissociation Spectrum of FeOH+: Electronic Insight into the Simplest Iron Hydroxide ComplexesShan Jin, Marcos Juanes, Marc Reimann, et al.Pageof 26