Matches in SemOpenAlex for { <https://semopenalex.org/work/W306804977> ?p ?o ?g. }
Showing items 1 to 94 of
94
with 100 items per page.
- W306804977 abstract "Total pi-electron energy (Epi) is one of the most important pieces of information about a conjugated molecule which can be obtained from simple Huckel molecular orbital (HMO) calculations. Moreover, HMO Epi ’s are often of the same degree of quantitative accuracy as those calculated by much more sophisticated SCF MO models. An intriguing result along these lines was obtained by Schaad and Hess,139 who showed that in many cases Epi follows linearly the total (thermodynamically measurable) energy of a conjugated compound. The physical reasons of how it is possible that such a simple model like HMO can give not only qualitative but sometimes also fair quantitative agreement with experimental findings are at present not well understood. However, in this chapter we shall not be involved in clarification of this complicated question, but we proceed with an “empirical” assumption that HMO theory works and that it is expecially reliable in reproducing total pi-electron energies. Our considerations will be always on a qualitative level." @default.
- W306804977 created "2016-06-24" @default.
- W306804977 creator A5008017709 @default.
- W306804977 creator A5039043627 @default.
- W306804977 creator A5072814838 @default.
- W306804977 date "1977-01-01" @default.
- W306804977 modified "2023-09-27" @default.
- W306804977 title "Total pi-Electron Energy" @default.
- W306804977 doi "https://doi.org/10.1007/978-3-642-93069-0_3" @default.
- W306804977 hasPublicationYear "1977" @default.
- W306804977 type Work @default.
- W306804977 sameAs 306804977 @default.
- W306804977 citedByCount "0" @default.
- W306804977 crossrefType "book-chapter" @default.
- W306804977 hasAuthorship W306804977A5008017709 @default.
- W306804977 hasAuthorship W306804977A5039043627 @default.
- W306804977 hasAuthorship W306804977A5072814838 @default.
- W306804977 hasConcept C107551265 @default.
- W306804977 hasConcept C111472728 @default.
- W306804977 hasConcept C112613896 @default.
- W306804977 hasConcept C121332964 @default.
- W306804977 hasConcept C121864883 @default.
- W306804977 hasConcept C138885662 @default.
- W306804977 hasConcept C139358910 @default.
- W306804977 hasConcept C147120987 @default.
- W306804977 hasConcept C147597530 @default.
- W306804977 hasConcept C15744967 @default.
- W306804977 hasConcept C184779094 @default.
- W306804977 hasConcept C185592680 @default.
- W306804977 hasConcept C186370098 @default.
- W306804977 hasConcept C2780586882 @default.
- W306804977 hasConcept C3020065929 @default.
- W306804977 hasConcept C32909587 @default.
- W306804977 hasConcept C33332235 @default.
- W306804977 hasConcept C33923547 @default.
- W306804977 hasConcept C46141821 @default.
- W306804977 hasConcept C521977710 @default.
- W306804977 hasConcept C53009064 @default.
- W306804977 hasConcept C542102704 @default.
- W306804977 hasConcept C55493867 @default.
- W306804977 hasConcept C62520636 @default.
- W306804977 hasConcept C66907805 @default.
- W306804977 hasConceptScore W306804977C107551265 @default.
- W306804977 hasConceptScore W306804977C111472728 @default.
- W306804977 hasConceptScore W306804977C112613896 @default.
- W306804977 hasConceptScore W306804977C121332964 @default.
- W306804977 hasConceptScore W306804977C121864883 @default.
- W306804977 hasConceptScore W306804977C138885662 @default.
- W306804977 hasConceptScore W306804977C139358910 @default.
- W306804977 hasConceptScore W306804977C147120987 @default.
- W306804977 hasConceptScore W306804977C147597530 @default.
- W306804977 hasConceptScore W306804977C15744967 @default.
- W306804977 hasConceptScore W306804977C184779094 @default.
- W306804977 hasConceptScore W306804977C185592680 @default.
- W306804977 hasConceptScore W306804977C186370098 @default.
- W306804977 hasConceptScore W306804977C2780586882 @default.
- W306804977 hasConceptScore W306804977C3020065929 @default.
- W306804977 hasConceptScore W306804977C32909587 @default.
- W306804977 hasConceptScore W306804977C33332235 @default.
- W306804977 hasConceptScore W306804977C33923547 @default.
- W306804977 hasConceptScore W306804977C46141821 @default.
- W306804977 hasConceptScore W306804977C521977710 @default.
- W306804977 hasConceptScore W306804977C53009064 @default.
- W306804977 hasConceptScore W306804977C542102704 @default.
- W306804977 hasConceptScore W306804977C55493867 @default.
- W306804977 hasConceptScore W306804977C62520636 @default.
- W306804977 hasConceptScore W306804977C66907805 @default.
- W306804977 hasLocation W3068049771 @default.
- W306804977 hasOpenAccess W306804977 @default.
- W306804977 hasPrimaryLocation W3068049771 @default.
- W306804977 hasRelatedWork W128499022 @default.
- W306804977 hasRelatedWork W1588048637 @default.
- W306804977 hasRelatedWork W1596667069 @default.
- W306804977 hasRelatedWork W1983967743 @default.
- W306804977 hasRelatedWork W1994083655 @default.
- W306804977 hasRelatedWork W2003301185 @default.
- W306804977 hasRelatedWork W2014679506 @default.
- W306804977 hasRelatedWork W2018741762 @default.
- W306804977 hasRelatedWork W2021223924 @default.
- W306804977 hasRelatedWork W2022368778 @default.
- W306804977 hasRelatedWork W2029178043 @default.
- W306804977 hasRelatedWork W2030744827 @default.
- W306804977 hasRelatedWork W2074842571 @default.
- W306804977 hasRelatedWork W2076837703 @default.
- W306804977 hasRelatedWork W2091677445 @default.
- W306804977 hasRelatedWork W2155938372 @default.
- W306804977 hasRelatedWork W2158476583 @default.
- W306804977 hasRelatedWork W3185047139 @default.
- W306804977 hasRelatedWork W800353133 @default.
- W306804977 hasRelatedWork W2014143369 @default.
- W306804977 isParatext "false" @default.
- W306804977 isRetracted "false" @default.
- W306804977 magId "306804977" @default.
- W306804977 workType "book-chapter" @default.