Excited state dynamics of PH··· HB and PH··· H-Si hydride-hydride interactions and potential dehydrogenation reactions in frustrated lewis pair
Y Yang, X Zhang, L Ding, Y Liu, T Guan, Y Liu - Physica Scripta, 2024 - iopscience.iop.org
Dihydrogen interactions plays a crucial role in frustrated Lewis pairs (FLPs) strategy and
promotes dehydrogenation reactions due to its low directionality and saturability. This work …
promotes dehydrogenation reactions due to its low directionality and saturability. This work …
Effect of boron halogenation on dihydrogen bonds: A quantum mechanical approach
S Arumugam, A Angamuthu, P Gopalan - Journal of Chemical Sciences, 2024 - Springer
Dihydrogen bond (DHB) interaction that exists in ammoniated metal borohydride systems is
recognized as an effective intermediate step involved in the evolution of H 2 molecules …
recognized as an effective intermediate step involved in the evolution of H 2 molecules …
Investigation of Dihydrogen Bonded Interaction in X3CH⋅⋅⋅HNa, X2CH2⋅⋅⋅HNa (X = F, Cl, and Br) Binary and Ternary Complexes: A DFT and DFT-D3 …
P Devi Duraisamy, S Prince Makarios Paul… - Russian Journal of …, 2023 - Springer
A theoretical study was conducted to investigate the dihydrogen and alkali-halogen bonding
in binary X3CH⋅⋅⋅ HNa, X2CH2⋅⋅⋅ HNa and ternary complexes 2 (X3CH)⋅⋅⋅ HNa, 2 …
in binary X3CH⋅⋅⋅ HNa, X2CH2⋅⋅⋅ HNa and ternary complexes 2 (X3CH)⋅⋅⋅ HNa, 2 …
Investigation of N–H⋅⋅⋅ H–M Dihydrogen Bonded Interactions in Adenine, Cytosine, Guanine, and Thymine with H–M (M= Li and Na) Complexes: A DFT Study
P Duraisamy, P Gopalan, A Angamuthu - Russian Journal of Physical …, 2022 - Springer
In this work, we have investigated the dihydrogen bond interaction of adenine, cytosine,
guanine and thymine with H–M (M= Li and Na) complexes to reveal the nature of N–H⋅⋅⋅ …
guanine and thymine with H–M (M= Li and Na) complexes to reveal the nature of N–H⋅⋅⋅ …
INVESTIGATION OF DIHYDROGEN BOND INTERACTION BETWEEN CYCLOALKENES AND ALKALI METAL HYDRIDES: A DFT APPROACH
D Parimala devi, G Praveena, R Jeba Beula… - Journal of Structural …, 2022 - Springer
In this work, intermolecular dihydrogen bonded interactions between cycloalkenes
(cyclobutene (C4H6), cyclopentene (C5H8), cyclohexene (C6H10)) and alkali metal …
(cyclobutene (C4H6), cyclopentene (C5H8), cyclohexene (C6H10)) and alkali metal …
THEORETICAL INVESTIGATION OF INTERMOLECULAR DIHYDROGEN BONDS IN C2H2••• HM AND C2H4••• HM (M= LI, NA AND K) COMPLEXES: A DFT AND AB …
G Tom, G Praveena, A Abiram - 2021 - dspaceir.psgrkcw.com
This study aims to investigate the dihydrogen bond formation in ethyne (C2H2) and ethene
(C2H4) with alkali metal hydrides (HM; M= Li, Na and K) complexes using density functional …
(C2H4) with alkali metal hydrides (HM; M= Li, Na and K) complexes using density functional …