FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2028249085> ?p ?o ?g. }

• W2028249085 endingPage "746" @default.
• W2028249085 startingPage "735" @default.
• W2028249085 abstract "With the aim of investigating the influence of direct intermolecular interactions between nitrile groups on the infrared features of nitrile polymers, vibrational frequencies and infrared intensities of acetonitrile and of its antiparallel dimer are compared. It is found that whereas frequencies are unchanged upon association infrared intensities are dramatically affected. In particular, the striking difference between the intensities of the CN stretching band measured in gas phase, on the one hand, and in the liquid, on the other, is already accounted for at the dimer level. Despite the poor reliability of absolute values of calculated intensities, it is interesting to note that consistent trends are obtained at various levels of theory. These results suggest that ab initio calculations of infrared intensities can be useful to interpret infrared measurements, thus contributing to the elucidation of molecular structure of materials. © 1993 John Wiley & Sons, Inc." @default.
• W2028249085 created "2016-06-24" @default.
• W2028249085 creator A5001512429 @default.
• W2028249085 creator A5020472212 @default.
• W2028249085 creator A5050897701 @default.
• W2028249085 date "1993-01-01" @default.
• W2028249085 modified "2023-09-27" @default.
• W2028249085 title "Ab initio study of the influence of aggregation on the infrared spectrum of acetonitrile" @default.
• W2028249085 cites W1963486098 @default.
• W2028249085 cites W1965193069 @default.
• W2028249085 cites W1965232561 @default.
• W2028249085 cites W1974129312 @default.
• W2028249085 cites W1975363381 @default.
• W2028249085 cites W1983004639 @default.
• W2028249085 cites W1992132166 @default.
• W2028249085 cites W1998177385 @default.
• W2028249085 cites W1999980231 @default.
• W2028249085 cites W2000116381 @default.
• W2028249085 cites W2002003458 @default.
• W2028249085 cites W2006011781 @default.
• W2028249085 cites W2045191822 @default.
• W2028249085 cites W2046465449 @default.
• W2028249085 cites W2046518817 @default.
• W2028249085 cites W2047161009 @default.
• W2028249085 cites W2048669762 @default.
• W2028249085 cites W2050130659 @default.
• W2028249085 cites W2051635154 @default.
• W2028249085 cites W2054562504 @default.
• W2028249085 cites W2064840837 @default.
• W2028249085 cites W2065470272 @default.
• W2028249085 cites W2069456714 @default.
• W2028249085 cites W2073188701 @default.
• W2028249085 cites W2075619587 @default.
• W2028249085 cites W2076296741 @default.
• W2028249085 cites W2081264747 @default.
• W2028249085 cites W2156812972 @default.
• W2028249085 cites W221777904 @default.
• W2028249085 cites W2329432665 @default.
• W2028249085 cites W3012793044 @default.
• W2028249085 doi "https://doi.org/10.1002/qua.560450620" @default.
• W2028249085 hasPublicationYear "1993" @default.
• W2028249085 type Work @default.
• W2028249085 sameAs 2028249085 @default.
• W2028249085 citedByCount "25" @default.
• W2028249085 countsByYear W20282490852014 @default.
• W2028249085 countsByYear W20282490852019 @default.
• W2028249085 countsByYear W20282490852020 @default.
• W2028249085 countsByYear W20282490852022 @default.
• W2028249085 crossrefType "journal-article" @default.
• W2028249085 hasAuthorship W2028249085A5001512429 @default.
• W2028249085 hasAuthorship W2028249085A5020472212 @default.
• W2028249085 hasAuthorship W2028249085A5050897701 @default.
• W2028249085 hasConcept C115260700 @default.
• W2028249085 hasConcept C120665830 @default.
• W2028249085 hasConcept C121332964 @default.
• W2028249085 hasConcept C142089489 @default.
• W2028249085 hasConcept C147597530 @default.
• W2028249085 hasConcept C147789679 @default.
• W2028249085 hasConcept C153642686 @default.
• W2028249085 hasConcept C158355884 @default.
• W2028249085 hasConcept C166950319 @default.
• W2028249085 hasConcept C178790620 @default.
• W2028249085 hasConcept C183971685 @default.
• W2028249085 hasConcept C185592680 @default.
• W2028249085 hasConcept C2777463227 @default.
• W2028249085 hasConcept C2779240715 @default.
• W2028249085 hasConcept C2779546866 @default.
• W2028249085 hasConcept C2781442258 @default.
• W2028249085 hasConcept C32909587 @default.
• W2028249085 hasConcept C62520636 @default.
• W2028249085 hasConceptScore W2028249085C115260700 @default.
• W2028249085 hasConceptScore W2028249085C120665830 @default.
• W2028249085 hasConceptScore W2028249085C121332964 @default.
• W2028249085 hasConceptScore W2028249085C142089489 @default.
• W2028249085 hasConceptScore W2028249085C147597530 @default.
• W2028249085 hasConceptScore W2028249085C147789679 @default.
• W2028249085 hasConceptScore W2028249085C153642686 @default.
• W2028249085 hasConceptScore W2028249085C158355884 @default.
• W2028249085 hasConceptScore W2028249085C166950319 @default.
• W2028249085 hasConceptScore W2028249085C178790620 @default.
• W2028249085 hasConceptScore W2028249085C183971685 @default.
• W2028249085 hasConceptScore W2028249085C185592680 @default.
• W2028249085 hasConceptScore W2028249085C2777463227 @default.
• W2028249085 hasConceptScore W2028249085C2779240715 @default.
• W2028249085 hasConceptScore W2028249085C2779546866 @default.
• W2028249085 hasConceptScore W2028249085C2781442258 @default.
• W2028249085 hasConceptScore W2028249085C32909587 @default.
• W2028249085 hasConceptScore W2028249085C62520636 @default.
• W2028249085 hasIssue "6" @default.
• W2028249085 hasLocation W20282490851 @default.
• W2028249085 hasOpenAccess W2028249085 @default.
• W2028249085 hasPrimaryLocation W20282490851 @default.
• W2028249085 hasRelatedWork W1941041028 @default.
• W2028249085 hasRelatedWork W1970966903 @default.
• W2028249085 hasRelatedWork W1974129312 @default.
• W2028249085 hasRelatedWork W2016912649 @default.
• W2028249085 hasRelatedWork W2028249085 @default.
• W2028249085 hasRelatedWork W2049182134 @default.

• next