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Please use this identifier to cite or link to this item: http://dspace.bits-pilani.ac.in:8080/jspui/handle/123456789/15582
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dc.contributor.authorChakraborty, Shamik-
dc.date.accessioned2024-09-14T06:52:48Z-
dc.date.available2024-09-14T06:52:48Z-
dc.date.issued2024-02-
dc.identifier.urihttps://link.springer.com/article/10.1007/s12648-024-03092-9-
dc.identifier.urihttp://dspace.bits-pilani.ac.in:8080/jspui/xmlui/handle/123456789/15582-
dc.description.abstractUnderstanding the nature of selenium centred hydrogen bond is a growing field of research. Intermolecular hydrogen bond has not yet been investigated experimentally in aromatic molecules. The current work aims at understanding the nature and origin of hydrogen bond interaction between phenylacetylene () and dimethyl selenide (). The 1:1 complex of [] is formed in nitrogen matrix at 14 K and probed using infrared spectroscopy. The experimentally obtained infrared spectra have been corroborated with simulated spectra. The nature of the complex has been delineated using Atoms in Molecules (AIM) theory, Natural Bond Orbital (NBO) analysis, and energy decomposition analysis by Symmetry Adapted Perturbation Theory (SAPT).en_US
dc.language.isoenen_US
dc.publisherSpringeren_US
dc.subjectChemistryen_US
dc.subjectSpectroscopicen_US
dc.subjectSymmetry Adapted Perturbation Theory (SAPT)en_US
dc.titleNovel intermolecular C–H Se hydrogen bond interaction: a matrix isolation infrared spectroscopic studyen_US
dc.typeArticleen_US
Appears in Collections:Department of Chemistry

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