Group 3 and lanthanide boryl compounds: syntheses, structures, and bonding analyses of Sc-B, Y-B, and Lu-B σ-coordinated NHC analogues

Autor:	Cameron Jones, Andrew D. Schwarz, Andrey V. Protchenko, Simon Aldridge, Philip Mountford, Krishna Hassomal Birjkumar, Liban M. A. Saleh, Nikolas Kaltsoyannis
Jazyk:	angličtina
Rok vydání:	2016
Předmět:	Lanthanide Stereochemistry Chemistry Ionic bonding General Chemistry Biochemistry Catalysis Ion Crystallography Colloid and Surface Chemistry Covalent bond Group (periodic table) Reactivity (chemistry) Density functional theory
DOI:	10.1021/ja2007092
Popis:	Reaction of [Ln(CH(2)SiMe(3))(2)(THF)(n)][BPh(4)] (Ln = Sc, Y, Lu ; n = 3, 4) with Li{B(NArCH)(2)}(THF)(2) (Ar = 2,6-C(6)H(3)(i)Pr(2)) formed the first group 3 and lanthanide boryl compounds, Sc{B(NArCH)(2)}(CH(2)SiMe(3))(2)(THF) and Ln{B(NArCH)(2)}(CH(2)SiMe(3))(2)(THF)(2) (Ln = Y, Lu), which contain two-center, two-electron Ln-B σ bonds. All of these systems were crystallographically characterized. Density functional theory analysis of the Ln-B bonding found it to be predominantly ionic, with covalent character in the σ-bonding Ln-B HOMO.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_dedup___::209df9398c3bd8b4113faa56a64d01a7 https://doi.org/10.1021/ja2007092 Zobrazit plný text záznamu