Matches in SemOpenAlex for { <https://semopenalex.org/work/W2358060835> ?p ?o ?g. }
Showing items 1 to 79 of
79
with 100 items per page.
- W2358060835 abstract "On the basis of the Gaussian09W program,the geometry configuration of a coumarin [3,4-c] six-mem bered heterocyclic derivative was optimized by density functional theory(DFT) method at B3LYP/6-311G(d) level.The steady configuration,the molecular energy,the energy of the highest occupied molecular orbital(HO MO),and the lowest unoccupied molecular orbital(LUMO) were got from the calculation results.On the basis of the optimized configuration,the IR vibrational spectra was obtained by the same method,and then,the spec tra was assigned." @default.
- W2358060835 created "2016-06-24" @default.
- W2358060835 creator A5084623346 @default.
- W2358060835 date "2013-01-01" @default.
- W2358060835 modified "2023-09-26" @default.
- W2358060835 title "Theoretical Research on Structure and Infrared Spectra of a Coumarin Heterocyclic Derivative" @default.
- W2358060835 hasPublicationYear "2013" @default.
- W2358060835 type Work @default.
- W2358060835 sameAs 2358060835 @default.
- W2358060835 citedByCount "0" @default.
- W2358060835 crossrefType "journal-article" @default.
- W2358060835 hasAuthorship W2358060835A5084623346 @default.
- W2358060835 hasConcept C106159729 @default.
- W2358060835 hasConcept C111771559 @default.
- W2358060835 hasConcept C120665830 @default.
- W2358060835 hasConcept C121332964 @default.
- W2358060835 hasConcept C139358910 @default.
- W2358060835 hasConcept C14158195 @default.
- W2358060835 hasConcept C147597530 @default.
- W2358060835 hasConcept C147789679 @default.
- W2358060835 hasConcept C152365726 @default.
- W2358060835 hasConcept C153642686 @default.
- W2358060835 hasConcept C158355884 @default.
- W2358060835 hasConcept C162324750 @default.
- W2358060835 hasConcept C178790620 @default.
- W2358060835 hasConcept C185592680 @default.
- W2358060835 hasConcept C192562407 @default.
- W2358060835 hasConcept C193547582 @default.
- W2358060835 hasConcept C2781338262 @default.
- W2358060835 hasConcept C32909587 @default.
- W2358060835 hasConcept C4839761 @default.
- W2358060835 hasConcept C62520636 @default.
- W2358060835 hasConceptScore W2358060835C106159729 @default.
- W2358060835 hasConceptScore W2358060835C111771559 @default.
- W2358060835 hasConceptScore W2358060835C120665830 @default.
- W2358060835 hasConceptScore W2358060835C121332964 @default.
- W2358060835 hasConceptScore W2358060835C139358910 @default.
- W2358060835 hasConceptScore W2358060835C14158195 @default.
- W2358060835 hasConceptScore W2358060835C147597530 @default.
- W2358060835 hasConceptScore W2358060835C147789679 @default.
- W2358060835 hasConceptScore W2358060835C152365726 @default.
- W2358060835 hasConceptScore W2358060835C153642686 @default.
- W2358060835 hasConceptScore W2358060835C158355884 @default.
- W2358060835 hasConceptScore W2358060835C162324750 @default.
- W2358060835 hasConceptScore W2358060835C178790620 @default.
- W2358060835 hasConceptScore W2358060835C185592680 @default.
- W2358060835 hasConceptScore W2358060835C192562407 @default.
- W2358060835 hasConceptScore W2358060835C193547582 @default.
- W2358060835 hasConceptScore W2358060835C2781338262 @default.
- W2358060835 hasConceptScore W2358060835C32909587 @default.
- W2358060835 hasConceptScore W2358060835C4839761 @default.
- W2358060835 hasConceptScore W2358060835C62520636 @default.
- W2358060835 hasLocation W23580608351 @default.
- W2358060835 hasOpenAccess W2358060835 @default.
- W2358060835 hasPrimaryLocation W23580608351 @default.
- W2358060835 hasRelatedWork W1965635418 @default.
- W2358060835 hasRelatedWork W1969056011 @default.
- W2358060835 hasRelatedWork W1973732700 @default.
- W2358060835 hasRelatedWork W1984653443 @default.
- W2358060835 hasRelatedWork W1996165885 @default.
- W2358060835 hasRelatedWork W1999478468 @default.
- W2358060835 hasRelatedWork W2006273641 @default.
- W2358060835 hasRelatedWork W2017180937 @default.
- W2358060835 hasRelatedWork W2035004529 @default.
- W2358060835 hasRelatedWork W2044538277 @default.
- W2358060835 hasRelatedWork W2073299153 @default.
- W2358060835 hasRelatedWork W2287230327 @default.
- W2358060835 hasRelatedWork W2345417369 @default.
- W2358060835 hasRelatedWork W2368225452 @default.
- W2358060835 hasRelatedWork W2380877080 @default.
- W2358060835 hasRelatedWork W2386180669 @default.
- W2358060835 hasRelatedWork W2519197894 @default.
- W2358060835 hasRelatedWork W2747676330 @default.
- W2358060835 hasRelatedWork W2964528022 @default.
- W2358060835 hasRelatedWork W3086067626 @default.
- W2358060835 isParatext "false" @default.
- W2358060835 isRetracted "false" @default.
- W2358060835 magId "2358060835" @default.
- W2358060835 workType "article" @default.