Matches in SemOpenAlex for { <https://semopenalex.org/work/W2003173680> ?p ?o ?g. }
- W2003173680 endingPage "204" @default.
- W2003173680 startingPage "192" @default.
- W2003173680 abstract "The liquid phase vibrational assignment and dipole moment derivatives of hexafluorobenzene are reported. These are obtained by fitting the imaginary molar polarizability spectrum of hexafluorobenzene to classical damped harmonic oscillator bands. Most of the observed transitions were assigned to infrared active fundamentals or binary combinations. From the active combination transitions, the wavenumbers of the inactive fundamentals were obtained. In addition, ab initio calculations at the CCD/cc-pVDZ level of theory were used to determine the harmonic force field and dipole moment derivatives of gaseous hexafluorobenzene. It was determined that in the gas phase ∂μy/∂s1=−5.53 Debye Å−1, ∂μx/∂t2=1.03, ∂μx/∂β1=0.78, and ∂μz/∂γ1=0.57 Debye Å−1 while in the liquid ∂μy/∂s1=−4.00 Debye Å−1, ∂μx/∂t2=1.27, and ∂μx/∂b1=0.50 Debye Å−1. ∂μz/∂γ1 could not be determined for the liquid phase because the fundamental is below the limits of the current measurements. The differences between the liquid and gas phase dipole moment derivatives of hexafluorobenzene were found to be consistent with the differences previously reported for benzene." @default.
- W2003173680 created "2016-06-24" @default.
- W2003173680 creator A5000211847 @default.
- W2003173680 creator A5063830861 @default.
- W2003173680 date "2006-03-01" @default.
- W2003173680 modified "2023-10-03" @default.
- W2003173680 title "Vibrational assignment and dipole moment derivatives of hexafluorobenzene between 4000 and 250cm−1" @default.
- W2003173680 cites W1968561122 @default.
- W2003173680 cites W1975002236 @default.
- W2003173680 cites W1978756330 @default.
- W2003173680 cites W1988462895 @default.
- W2003173680 cites W1993077801 @default.
- W2003173680 cites W1999225355 @default.
- W2003173680 cites W2003482524 @default.
- W2003173680 cites W2008117787 @default.
- W2003173680 cites W2011204750 @default.
- W2003173680 cites W2022954694 @default.
- W2003173680 cites W2029930488 @default.
- W2003173680 cites W2034815131 @default.
- W2003173680 cites W2038174405 @default.
- W2003173680 cites W2042051760 @default.
- W2003173680 cites W2044050261 @default.
- W2003173680 cites W2044750618 @default.
- W2003173680 cites W2062423467 @default.
- W2003173680 cites W2062466647 @default.
- W2003173680 cites W2065419394 @default.
- W2003173680 cites W2069006374 @default.
- W2003173680 cites W2073481515 @default.
- W2003173680 cites W2078851918 @default.
- W2003173680 cites W2080618037 @default.
- W2003173680 cites W2091136699 @default.
- W2003173680 cites W2092377143 @default.
- W2003173680 cites W2112641364 @default.
- W2003173680 cites W2133206767 @default.
- W2003173680 cites W2136404361 @default.
- W2003173680 cites W2137408852 @default.
- W2003173680 cites W2166478659 @default.
- W2003173680 cites W2186630963 @default.
- W2003173680 cites W2524921683 @default.
- W2003173680 cites W4233137465 @default.
- W2003173680 cites W4240035468 @default.
- W2003173680 doi "https://doi.org/10.1016/j.molstruc.2005.10.010" @default.
- W2003173680 hasPublicationYear "2006" @default.
- W2003173680 type Work @default.
- W2003173680 sameAs 2003173680 @default.
- W2003173680 citedByCount "6" @default.
- W2003173680 countsByYear W20031736802012 @default.
- W2003173680 countsByYear W20031736802014 @default.
- W2003173680 crossrefType "journal-article" @default.
- W2003173680 hasAuthorship W2003173680A5000211847 @default.
- W2003173680 hasAuthorship W2003173680A5063830861 @default.
- W2003173680 hasConcept C121332964 @default.
- W2003173680 hasConcept C139287275 @default.
- W2003173680 hasConcept C147597530 @default.
- W2003173680 hasConcept C158355884 @default.
- W2003173680 hasConcept C173523689 @default.
- W2003173680 hasConcept C178790620 @default.
- W2003173680 hasConcept C179254644 @default.
- W2003173680 hasConcept C184779094 @default.
- W2003173680 hasConcept C185592680 @default.
- W2003173680 hasConcept C2776840056 @default.
- W2003173680 hasConcept C2777691172 @default.
- W2003173680 hasConcept C32909587 @default.
- W2003173680 hasConcept C40899509 @default.
- W2003173680 hasConcept C41999313 @default.
- W2003173680 hasConcept C62520636 @default.
- W2003173680 hasConceptScore W2003173680C121332964 @default.
- W2003173680 hasConceptScore W2003173680C139287275 @default.
- W2003173680 hasConceptScore W2003173680C147597530 @default.
- W2003173680 hasConceptScore W2003173680C158355884 @default.
- W2003173680 hasConceptScore W2003173680C173523689 @default.
- W2003173680 hasConceptScore W2003173680C178790620 @default.
- W2003173680 hasConceptScore W2003173680C179254644 @default.
- W2003173680 hasConceptScore W2003173680C184779094 @default.
- W2003173680 hasConceptScore W2003173680C185592680 @default.
- W2003173680 hasConceptScore W2003173680C2776840056 @default.
- W2003173680 hasConceptScore W2003173680C2777691172 @default.
- W2003173680 hasConceptScore W2003173680C32909587 @default.
- W2003173680 hasConceptScore W2003173680C40899509 @default.
- W2003173680 hasConceptScore W2003173680C41999313 @default.
- W2003173680 hasConceptScore W2003173680C62520636 @default.
- W2003173680 hasIssue "1-3" @default.
- W2003173680 hasLocation W20031736801 @default.
- W2003173680 hasOpenAccess W2003173680 @default.
- W2003173680 hasPrimaryLocation W20031736801 @default.
- W2003173680 hasRelatedWork W1970774865 @default.
- W2003173680 hasRelatedWork W1997154971 @default.
- W2003173680 hasRelatedWork W2022551225 @default.
- W2003173680 hasRelatedWork W2038628417 @default.
- W2003173680 hasRelatedWork W2053041863 @default.
- W2003173680 hasRelatedWork W2054160223 @default.
- W2003173680 hasRelatedWork W2106007828 @default.
- W2003173680 hasRelatedWork W2107075767 @default.
- W2003173680 hasRelatedWork W2132480759 @default.
- W2003173680 hasRelatedWork W2168718685 @default.
- W2003173680 hasVolume "785" @default.
- W2003173680 isParatext "false" @default.
- W2003173680 isRetracted "false" @default.