Carbonyl Carbon and Nitrogen Chemical Shift Tensors of the Amide Fragment of Acetanilide and N-Methylacetanilide

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Vol 116 (4) ◽  
pp. 1403-1413 ◽  
Author(s):  
Michael D. Lumsden ◽  
Roderick E. Wasylishen ◽  
Klaus Eichele ◽  
Michael Schindler ◽  
Glenn H. Penner ◽  
...  
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Vol 109 (20) ◽  
pp. 5956-5962 ◽  
Author(s):  
Terrence G. Oas ◽  
Cynthia J. Hartzell ◽  
Thomas J. McMahon ◽  
Gary P. Drobny ◽  
Frederick W. Dahlquist

ChemPhysChem ◽  
2021 ◽  
Author(s):  
Luther Wang ◽  
Alexander B. Elliott ◽  
Sean D. Moore ◽  
Gregory J. O. Beran ◽  
Joshua D. Hartman ◽  
...  

2015 ◽  
Vol 17 (38) ◽  
pp. 25014-25026 ◽  
Author(s):  
Fahri Alkan ◽  
C. Dybowski

Accurate computation of 207Pb magnetic shielding principal components is within the reach of quantum chemistry methods by employing relativistic ZORA/DFT and cluster models adapted from the bond valence model.


2019 ◽  
Vol 150 (14) ◽  
pp. 144706 ◽  
Author(s):  
Ivan Yu. Chernyshov ◽  
Mikhail V. Vener ◽  
Ilya G. Shenderovich

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