Understanding the extraordinary deshielding of 129Xe in a permetallated cryptophane by relativistic DFT

Chemistry - A European Journal

Volumn 18, Issue 24, 2012, Pages 7341-7345

  Bagno, Alessandro ^a   Saielli, Giacomo ^b  

^a UNIVERSITY OF PADOVA   (Italy)

^b INSTITUTE ON MEMBRANE TECHNOLOGY   (Italy)

Author keywords

cryptophane; density functional calculations; NMR spectroscopy; ruthenium; xenon

Indexed keywords

CRYPTOPHANE; DESHIELDING; DFT CALCULATION; METAL CENTRES; SHIFT CHANGES; SOLVENT EFFECTS; SPIN-ORBIT COUPLINGS;

NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; RUTHENIUM; XENON;

DENSITY FUNCTIONAL THEORY;

EID: 84861820578     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.201103979     Document Type: Article

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