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Chernyshov, Ivan Yu., Vener, Mikhail V., Shenderovich, Ilya G. (2019) Local-structure effects on 31P NMR chemical shift tensors in solid state. The Journal of Chemical Physics, 150 (14). 144706pp. doi:10.1063/1.5075519

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Reference TypeJournal (article/letter/editorial)
TitleLocal-structure effects on 31P NMR chemical shift tensors in solid state
JournalThe Journal of Chemical Physics
AuthorsChernyshov, Ivan Yu.Author
Vener, Mikhail V.Author
Shenderovich, Ilya G.Author
Year2019 (April 14)Volume150
Issue14
PublisherAIP Publishing
DOIdoi:10.1063/1.5075519Search in ResearchGate
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Mindat Ref. ID2403334Long-form Identifiermindat:1:5:2403334:5
GUID0
Full ReferenceChernyshov, Ivan Yu., Vener, Mikhail V., Shenderovich, Ilya G. (2019) Local-structure effects on 31P NMR chemical shift tensors in solid state. The Journal of Chemical Physics, 150 (14). 144706pp. doi:10.1063/1.5075519
Plain TextChernyshov, Ivan Yu., Vener, Mikhail V., Shenderovich, Ilya G. (2019) Local-structure effects on 31P NMR chemical shift tensors in solid state. The Journal of Chemical Physics, 150 (14). 144706pp. doi:10.1063/1.5075519
In(2019, April) The Journal of Chemical Physics Vol. 150 (14) AIP Publishing

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Shenderovich, Ilya G. (2020) Electric field effect on 31P NMR magnetic shielding. The Journal of Chemical Physics, 153 (18) 184501pp. doi:10.1063/5.0031167
Tupikina, E. Yu., Sigalov, M., Shenderovich, I. G., Mulloyarova, V. V., Denisov, G. S., Tolstoy, P. M. (2019) Correlations of NHN hydrogen bond energy with geometry and1H NMR chemical shift difference of NH protons for aniline complexes. The Journal of Chemical Physics, 150 (11). 114305pp. doi:10.1063/1.5090180
Shenderovich, Ilya G., Denisov, Gleb S. (2019) Solvent effects on acid-base complexes. What is more important: A macroscopic reaction field or solute-solvent interactions?. The Journal of Chemical Physics, 150 (20). 204505pp. doi:10.1063/1.5096946
Dutasta, J.P., Robert, J.B., Wiesenfeld, L. (1981) 31P Solid state NMR geometrical effects on the chemical shift tensor. Chemical Physics Letters, 77. 336-338 doi:10.1016/0009-2614(81)80159-5
Levina, Elena O., Chernyshov, Ivan Y., Voronin, Alexander P., Alekseiko, Leonid N., Stash, Adam I., Vener, Mikhail V. (2019) Solving the enigma of weak fluorine contacts in the solid state: a periodic DFT study of fluorinated organic crystals. RSC Advances, 9 (22). 12520-12537 doi:10.1039/c9ra02116g
Shenderovich, Ilya G. (2013) Effect of Noncovalent Interactions on the 31P Chemical Shift Tensor of Phosphine Oxides, Phosphinic, Phosphonic, and Phosphoric Acids, and Their Complexes with Lead(II). The Journal of Physical Chemistry C, 117 (50). 26689-26702 doi:10.1021/jp4102064
Begimova, Gulzeinep, Tupikina, Elena Yu., Yu, Valentina K., Denisov, Gleb S., Bodensteiner, Michael, Shenderovich, Ilya G. (2016) Effect of Hydrogen Bonding to Water on the 31P Chemical Shift Tensor of Phenyl- and Trialkylphosphine Oxides and α-Amino Phosphonates. The Journal of Physical Chemistry C, 120 (16). 8717-8729 doi:10.1021/acs.jpcc.6b01140
Schneider, D., Caputo, M., Ferraro, M., Facelli, J. (2000) Modeling NMR chemical shifts: crystal potential derived point charge (CPPCh) model to calculate solid state effects on 31P chemical shifts tensors. International Journal of Molecular Sciences, 1. 75-83 doi:10.3390/ijms1040075
Vener, M.V. (1992) Model study of the primary H/D isotope effects on the NMR chemical shift in strong hydrogen-bonded systems. Chemical Physics, 166. 311-316 doi:10.1016/0301-0104(92)80091-9
Vener, M. V., Chernyshov, I. Yu., Rykounov, A. A., Filarowski, A. (2018) Structural and spectroscopic features of proton hydrates in the crystalline state. Solid-state DFT study on HCl and triflic acid hydrates. Molecular Physics, 116. 251-262 doi:10.1080/00268976.2017.1380860
Lipparini, Filippo, Mennucci, Benedetta (2007) Embedding effects on charge-transport parameters in molecular organic materials. The Journal of Chemical Physics, 127 (14). 144706pp. doi:10.1063/1.2786459
 
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