FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2028159797> ?p ?o ?g. }

• W2028159797 endingPage "5272" @default.
• W2028159797 startingPage "5266" @default.
• W2028159797 abstract "Valence bond (VB) theory and ring-current maps have been used to study the electronic structure of inorganic benzene analogues X(6)H(6) (X = C (1), Si (2)), X(6) (X = N (3), P (4)), X(3)Y(3)H(6) (X,Y = B,N (5), B,P (6), Al,N (7), Al,P (8)), and B(3)Y(3)H(3) (Y = O (9), S (10)). It is shown that the homonuclear compounds possess benzene-like character, with resonance between two Kekulé-like structures and induced diatropic ring currents. Heteronuclear compounds typically show localization of the lone pairs on the electronegative atoms; Kekulé-like structures do not contribute. Of the heteronuclear compounds, only B(3)P(3)H(6) (6) has some benzene-like features with a significant contribution of two Kekulé-like structures to its VB wave function, an appreciable resonance energy, and a discernible diatropic ring current in planar geometry. However, relaxation of 6 to the optimal nonplanar chair conformation is accompanied by the onset of localization of the ring current." @default.
• W2028159797 created "2016-06-24" @default.
• W2028159797 creator A5025309888 @default.
• W2028159797 creator A5035063945 @default.
• W2028159797 creator A5036019750 @default.
• W2028159797 creator A5036075795 @default.
• W2028159797 creator A5046067905 @default.
• W2028159797 date "2005-06-14" @default.
• W2028159797 modified "2023-10-14" @default.
• W2028159797 title "The Electronic Structure of Inorganic Benzenes: Valence Bond and Ring-Current Descriptions" @default.
• W2028159797 cites W1789884215 @default.
• W2028159797 cites W1967097715 @default.
• W2028159797 cites W1970838008 @default.
• W2028159797 cites W1979993712 @default.
• W2028159797 cites W1983853807 @default.
• W2028159797 cites W1986418606 @default.
• W2028159797 cites W2011099326 @default.
• W2028159797 cites W2013842976 @default.
• W2028159797 cites W2016555809 @default.
• W2028159797 cites W2025217376 @default.
• W2028159797 cites W2029532817 @default.
• W2028159797 cites W2033990154 @default.
• W2028159797 cites W2036578811 @default.
• W2028159797 cites W2038690005 @default.
• W2028159797 cites W2039943569 @default.
• W2028159797 cites W2040134477 @default.
• W2028159797 cites W2045214161 @default.
• W2028159797 cites W2054176454 @default.
• W2028159797 cites W2061111213 @default.
• W2028159797 cites W2062348717 @default.
• W2028159797 cites W2064816552 @default.
• W2028159797 cites W2069796488 @default.
• W2028159797 cites W2073149497 @default.
• W2028159797 cites W2079473982 @default.
• W2028159797 cites W2079580321 @default.
• W2028159797 cites W2089692624 @default.
• W2028159797 cites W2090634772 @default.
• W2028159797 cites W2098023597 @default.
• W2028159797 cites W2099889942 @default.
• W2028159797 cites W2102164624 @default.
• W2028159797 cites W2126951867 @default.
• W2028159797 cites W2131587491 @default.
• W2028159797 cites W2135064782 @default.
• W2028159797 cites W2135735197 @default.
• W2028159797 cites W2166201965 @default.
• W2028159797 cites W2315972217 @default.
• W2028159797 cites W2328978235 @default.
• W2028159797 cites W2950421303 @default.
• W2028159797 cites W2951062436 @default.
• W2028159797 doi "https://doi.org/10.1021/ic050017o" @default.
• W2028159797 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/16022524" @default.
• W2028159797 hasPublicationYear "2005" @default.
• W2028159797 type Work @default.
• W2028159797 sameAs 2028159797 @default.
• W2028159797 citedByCount "69" @default.
• W2028159797 countsByYear W20281597972012 @default.
• W2028159797 countsByYear W20281597972013 @default.
• W2028159797 countsByYear W20281597972014 @default.
• W2028159797 countsByYear W20281597972015 @default.
• W2028159797 countsByYear W20281597972016 @default.
• W2028159797 countsByYear W20281597972017 @default.
• W2028159797 countsByYear W20281597972018 @default.
• W2028159797 countsByYear W20281597972019 @default.
• W2028159797 countsByYear W20281597972020 @default.
• W2028159797 countsByYear W20281597972021 @default.
• W2028159797 countsByYear W20281597972022 @default.
• W2028159797 countsByYear W20281597972023 @default.
• W2028159797 crossrefType "journal-article" @default.
• W2028159797 hasAuthorship W2028159797A5025309888 @default.
• W2028159797 hasAuthorship W2028159797A5035063945 @default.
• W2028159797 hasAuthorship W2028159797A5036019750 @default.
• W2028159797 hasAuthorship W2028159797A5036075795 @default.
• W2028159797 hasAuthorship W2028159797A5046067905 @default.
• W2028159797 hasBestOaLocation W20281597972 @default.
• W2028159797 hasConcept C115260700 @default.
• W2028159797 hasConcept C121332964 @default.
• W2028159797 hasConcept C139210041 @default.
• W2028159797 hasConcept C139358910 @default.
• W2028159797 hasConcept C147597530 @default.
• W2028159797 hasConcept C168900304 @default.
• W2028159797 hasConcept C178429038 @default.
• W2028159797 hasConcept C178790620 @default.
• W2028159797 hasConcept C184779094 @default.
• W2028159797 hasConcept C185592680 @default.
• W2028159797 hasConcept C199635899 @default.
• W2028159797 hasConcept C2777691172 @default.
• W2028159797 hasConcept C2780378348 @default.
• W2028159797 hasConcept C32909587 @default.
• W2028159797 hasConcept C40447573 @default.
• W2028159797 hasConcept C62520636 @default.
• W2028159797 hasConcept C66974803 @default.
• W2028159797 hasConcept C71240020 @default.
• W2028159797 hasConcept C8010536 @default.
• W2028159797 hasConcept C86025842 @default.
• W2028159797 hasConcept C92381491 @default.
• W2028159797 hasConcept C9844520 @default.
• W2028159797 hasConceptScore W2028159797C115260700 @default.
• W2028159797 hasConceptScore W2028159797C121332964 @default.

• next