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UnknownOn the competition between weak O-H···F and C-H···F hydrogen bonds, in cooperation with C-H···O contacts, in the difluoromethane - tert-butyl alcohol cluster.
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S-EPMC5597040 | biostudies-literature
UnknownComputational Protocol for the Identification of Candidates for Radioastronomical Detection and Its Application to the C3H3NO Family of Isomers.
Not available
S-EPMC10096335 | biostudies-literature
UnknownLaboratory measurements and astronomical search for cyanomethanimine.
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S-EPMC6071866 | biostudies-literature
UnknownRotational Spectroscopy Meets Quantum Chemistry for Analyzing Substituent Effects on Non-Covalent Interactions: The Case of the Trifluoroacetophenone-Water Complex.
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S-EPMC7660205 | biostudies-literature
UnknownInsights into the Molecular Structure and Spectroscopic Properties of HONCO: An Accurate Ab Initio Study.
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S-EPMC10658623 | biostudies-literature
UnknownCorrect Modeling of Cisplatin: a Paradigmatic Case.
Not available
S-EPMC5656895 | biostudies-literature
UnknownState-of-the-Art Quantum Chemistry Meets Variable Reaction Coordinate Transition State Theory to Solve the Puzzling Case of the H2S + Cl System.
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S-EPMC8009477 | biostudies-literature
UnknownComputational Study of the Reaction between Ethylene Glycol and the CH Radical: Competition between Carbon Addition and Dehydrogenation.
Not available
S-EPMC12908157 | biostudies-literature
UnknownAccurate molecular structures and infrared spectra of trans-2,3-dideuterooxirane, methyloxirane, and trans-2,3-dimethyloxirane.
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S-EPMC4612369 | biostudies-literature
UnknownACCURATE SPECTROSCOPIC CHARACTERIZATION OF OXIRANE: A VALUABLE ROUTE TO ITS IDENTIFICATION IN TITAN'S ATMOSPHERE AND THE ASSIGNMENT OF UNIDENTIFIED INFRARED BANDS.
Not available
S-EPMC4630858 | biostudies-literature
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