FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2024663109> ?p ?o ?g. }

• W2024663109 endingPage "16" @default.
• W2024663109 startingPage "6" @default.
• W2024663109 abstract "The molecular structures and vibrational spectra of the three isomers of pyridinecarboxamide (picolinamide, nicotinamide, isonicotinamide) were calculated with the Density Functional Theory (DFT) method using the B3LYP function and the 6-31++G(d,p), Z2PolX, Z3PolX basis sets. The calculations were performed by using the Gaussian98W packet program set. The total energy distributions (TED) of the vibrational modes of these molecules were calculated by using the Scale 2.0 program and the vibrational modes of the molecules were determined. The Scaled Quantum Mechanical (SQM) method was used in the scaling procedure. In the experimental part of the study, the solid phase FT-IR and Micro Raman spectra of the three isomers of pyridinecarboxamide have been recorded in the range of 4000–650 and 1200–100 cm−1, respectively. The calculated wavenumbers were compared to the corresponding experimental values. As a result, the observed bands of the three isomers of pyridinecarboxamide were assigned with good accuracy." @default.
• W2024663109 created "2016-06-24" @default.
• W2024663109 creator A5018942693 @default.
• W2024663109 creator A5021605634 @default.
• W2024663109 creator A5030615377 @default.
• W2024663109 date "2007-01-01" @default.
• W2024663109 modified "2023-10-10" @default.
• W2024663109 title "An experimental and theoretical study of vibrational spectra of picolinamide, nicotinamide, and isonicotinamide" @default.
• W2024663109 cites W1963737654 @default.
• W2024663109 cites W1989669303 @default.
• W2024663109 cites W1991086790 @default.
• W2024663109 cites W1993925080 @default.
• W2024663109 cites W1998063529 @default.
• W2024663109 cites W2023271753 @default.
• W2024663109 cites W2055639835 @default.
• W2024663109 cites W2085375232 @default.
• W2024663109 cites W2090031519 @default.
• W2024663109 cites W2092233442 @default.
• W2024663109 cites W2105160719 @default.
• W2024663109 cites W2135506601 @default.
• W2024663109 cites W2140492656 @default.
• W2024663109 cites W2143981217 @default.
• W2024663109 cites W2159622194 @default.
• W2024663109 doi "https://doi.org/10.1016/j.molstruc.2006.04.021" @default.
• W2024663109 hasPublicationYear "2007" @default.
• W2024663109 type Work @default.
• W2024663109 sameAs 2024663109 @default.
• W2024663109 citedByCount "51" @default.
• W2024663109 countsByYear W20246631092012 @default.
• W2024663109 countsByYear W20246631092013 @default.
• W2024663109 countsByYear W20246631092014 @default.
• W2024663109 countsByYear W20246631092015 @default.
• W2024663109 countsByYear W20246631092016 @default.
• W2024663109 countsByYear W20246631092017 @default.
• W2024663109 countsByYear W20246631092018 @default.
• W2024663109 countsByYear W20246631092019 @default.
• W2024663109 countsByYear W20246631092020 @default.
• W2024663109 countsByYear W20246631092021 @default.
• W2024663109 countsByYear W20246631092022 @default.
• W2024663109 countsByYear W20246631092023 @default.
• W2024663109 crossrefType "journal-article" @default.
• W2024663109 hasAuthorship W2024663109A5018942693 @default.
• W2024663109 hasAuthorship W2024663109A5021605634 @default.
• W2024663109 hasAuthorship W2024663109A5030615377 @default.
• W2024663109 hasConcept C112887158 @default.
• W2024663109 hasConcept C113196181 @default.
• W2024663109 hasConcept C120665830 @default.
• W2024663109 hasConcept C121332964 @default.
• W2024663109 hasConcept C1276947 @default.
• W2024663109 hasConcept C147597530 @default.
• W2024663109 hasConcept C147789679 @default.
• W2024663109 hasConcept C152365726 @default.
• W2024663109 hasConcept C178790620 @default.
• W2024663109 hasConcept C181199279 @default.
• W2024663109 hasConcept C185592680 @default.
• W2024663109 hasConcept C24123453 @default.
• W2024663109 hasConcept C2777246417 @default.
• W2024663109 hasConcept C2779728014 @default.
• W2024663109 hasConcept C32909587 @default.
• W2024663109 hasConcept C40003534 @default.
• W2024663109 hasConcept C41999313 @default.
• W2024663109 hasConcept C4839761 @default.
• W2024663109 hasConcept C65956243 @default.
• W2024663109 hasConceptScore W2024663109C112887158 @default.
• W2024663109 hasConceptScore W2024663109C113196181 @default.
• W2024663109 hasConceptScore W2024663109C120665830 @default.
• W2024663109 hasConceptScore W2024663109C121332964 @default.
• W2024663109 hasConceptScore W2024663109C1276947 @default.
• W2024663109 hasConceptScore W2024663109C147597530 @default.
• W2024663109 hasConceptScore W2024663109C147789679 @default.
• W2024663109 hasConceptScore W2024663109C152365726 @default.
• W2024663109 hasConceptScore W2024663109C178790620 @default.
• W2024663109 hasConceptScore W2024663109C181199279 @default.
• W2024663109 hasConceptScore W2024663109C185592680 @default.
• W2024663109 hasConceptScore W2024663109C24123453 @default.
• W2024663109 hasConceptScore W2024663109C2777246417 @default.
• W2024663109 hasConceptScore W2024663109C2779728014 @default.
• W2024663109 hasConceptScore W2024663109C32909587 @default.
• W2024663109 hasConceptScore W2024663109C40003534 @default.
• W2024663109 hasConceptScore W2024663109C41999313 @default.
• W2024663109 hasConceptScore W2024663109C4839761 @default.
• W2024663109 hasConceptScore W2024663109C65956243 @default.
• W2024663109 hasIssue "1" @default.
• W2024663109 hasLocation W20246631091 @default.
• W2024663109 hasOpenAccess W2024663109 @default.
• W2024663109 hasPrimaryLocation W20246631091 @default.
• W2024663109 hasRelatedWork W170111447 @default.
• W2024663109 hasRelatedWork W1966031822 @default.
• W2024663109 hasRelatedWork W1999589640 @default.
• W2024663109 hasRelatedWork W2027377522 @default.
• W2024663109 hasRelatedWork W2043370096 @default.
• W2024663109 hasRelatedWork W2078654761 @default.
• W2024663109 hasRelatedWork W2090026097 @default.
• W2024663109 hasRelatedWork W2107932789 @default.
• W2024663109 hasRelatedWork W2188489321 @default.
• W2024663109 hasRelatedWork W2016562941 @default.
• W2024663109 hasVolume "826" @default.
• W2024663109 isParatext "false" @default.

• next