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Calculations of NMR chemical shifts in solids

Calculations of NMR chemical shifts in solids. Peter Blaha Institute of Materials Chemistry TU Vienna, Austria. NMR spectroscopy. NMR Hamiltonian. perturbation. Indirect spin-spin coupling. electric quadrupole interaction (EFG). direct dipolar coupling. Zeeman Hamiltonian.

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732 views • 46 slides

Conjugation

Conjugation. Which of the following compounds is conjugated?. Conjugation. Which of the following compounds is not conjugated?. Slides 4 and 5 are part of the same question. Butadiene. 2 conformations possible, both overall planar. Butadiene. Which conformation appears to be more stable?

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752 views • 24 slides

Lewis Structure

Lewis Structure. Localized Electron Bonding Model. A molecule is composed of atoms that are bound together by sharing electron pairs. A bonding pair is of which two electrons are localized between two adjacent nuclei. A lone pair is that the electron pair is

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286 views • 21 slides

STRUCTURE: Bonding

STRUCTURE: Bonding. S.C. BAYNE, 1 J.Y. Thompson 2 1 University of Michigan School of Dentistry, Ann Arbor, MI 48109-1078 sbayne@umich.edu 2 Nova Southeastern College of Dental Medicine, Ft. Lauderdale, FL 33328-2018 jeffthom@nova.edu. 3s. 2p. 2s. 1s. INTRODUCTION

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150 views • 12 slides

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Bonding character - PowerPoint PPT Presentation

Calculations of NMR chemical shifts in solids

Conjugation

Lewis Structure

STRUCTURE: Bonding