Matches in SemOpenAlex for { <https://semopenalex.org/work/W2094667241> ?p ?o ?g. }
Showing items 1 to 68 of
68
with 100 items per page.
- W2094667241 endingPage "1504" @default.
- W2094667241 startingPage "1499" @default.
- W2094667241 abstract "Abstract Ab initio calculations with both all-electron basis sets and effective core potentials (ECP) were employed to study the bonding in chain-like polyhalogen cations and anions. An electron density analysis based on Bader's theory of atoms in molecules shows that these polyhalogen cations and anions can be described in terms of the VSEPR model. On the basis of this analysis one can also distinguish covalent and dative bonds in these polyhalogen cations and anions. Covalent bonds exist only between atoms where both are four-coordinate (including the number of lone pairs), because higher coordinate halogens must form a three-centre four-electron bond with its adjacent atoms. The arrangement of iodine-fluorine contacts in the crystal structure of (I5+)(AsF6−) can be explained by the distributions of lone pairs associated with the relevant iodines." @default.
- W2094667241 created "2016-06-24" @default.
- W2094667241 creator A5054639075 @default.
- W2094667241 creator A5061126493 @default.
- W2094667241 date "1993-01-01" @default.
- W2094667241 modified "2023-09-23" @default.
- W2094667241 title "Structure and bonding in chain-like polyhalonium cations and polyhalide anions" @default.
- W2094667241 cites W1985520140 @default.
- W2094667241 cites W1991956078 @default.
- W2094667241 cites W1997174451 @default.
- W2094667241 cites W2018089217 @default.
- W2094667241 cites W2023989469 @default.
- W2094667241 cites W2029897639 @default.
- W2094667241 cites W2041086453 @default.
- W2094667241 cites W2068617439 @default.
- W2094667241 cites W2074190083 @default.
- W2094667241 cites W2102964261 @default.
- W2094667241 cites W2163914696 @default.
- W2094667241 cites W2169388591 @default.
- W2094667241 cites W2344147076 @default.
- W2094667241 cites W3004465863 @default.
- W2094667241 cites W3139429797 @default.
- W2094667241 cites W4233998925 @default.
- W2094667241 doi "https://doi.org/10.1016/s0277-5387(00)84589-1" @default.
- W2094667241 hasPublicationYear "1993" @default.
- W2094667241 type Work @default.
- W2094667241 sameAs 2094667241 @default.
- W2094667241 citedByCount "24" @default.
- W2094667241 countsByYear W20946672412014 @default.
- W2094667241 countsByYear W20946672412018 @default.
- W2094667241 countsByYear W20946672412021 @default.
- W2094667241 countsByYear W20946672412022 @default.
- W2094667241 crossrefType "journal-article" @default.
- W2094667241 hasAuthorship W2094667241A5054639075 @default.
- W2094667241 hasAuthorship W2094667241A5061126493 @default.
- W2094667241 hasConcept C121332964 @default.
- W2094667241 hasConcept C1276947 @default.
- W2094667241 hasConcept C185592680 @default.
- W2094667241 hasConcept C199185054 @default.
- W2094667241 hasConcept C71240020 @default.
- W2094667241 hasConcept C8010536 @default.
- W2094667241 hasConceptScore W2094667241C121332964 @default.
- W2094667241 hasConceptScore W2094667241C1276947 @default.
- W2094667241 hasConceptScore W2094667241C185592680 @default.
- W2094667241 hasConceptScore W2094667241C199185054 @default.
- W2094667241 hasConceptScore W2094667241C71240020 @default.
- W2094667241 hasConceptScore W2094667241C8010536 @default.
- W2094667241 hasIssue "12" @default.
- W2094667241 hasLocation W20946672411 @default.
- W2094667241 hasOpenAccess W2094667241 @default.
- W2094667241 hasPrimaryLocation W20946672411 @default.
- W2094667241 hasRelatedWork W1996140555 @default.
- W2094667241 hasRelatedWork W2085061074 @default.
- W2094667241 hasRelatedWork W2104245367 @default.
- W2094667241 hasRelatedWork W2316718896 @default.
- W2094667241 hasRelatedWork W2345358426 @default.
- W2094667241 hasRelatedWork W2345392893 @default.
- W2094667241 hasRelatedWork W2605000765 @default.
- W2094667241 hasRelatedWork W2952015426 @default.
- W2094667241 hasRelatedWork W2952526157 @default.
- W2094667241 hasRelatedWork W2464941434 @default.
- W2094667241 hasVolume "12" @default.
- W2094667241 isParatext "false" @default.
- W2094667241 isRetracted "false" @default.
- W2094667241 magId "2094667241" @default.
- W2094667241 workType "article" @default.