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Matches in SemOpenAlex for { <https://semopenalex.org/work/W2005229058> ?p ?o ?g. }

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• W2005229058 abstract "Density functional theory calculations at the Becke3LYP level have been performed to study structural isomers of borane adducts of Cp2M(H) (M=Nb, Ta). Results of calculations show that O- and N-substituted borane adducts can have various structural isomers including boryl, hydridoborate and σ-complex structures. H-, alkyl- and Cl-substituted borane adducts are found to adopt hydridoborate structures. The structural feature is closely related to how the electron-deficient boron center is electronically saturated." @default.
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• W2005229058 date "2003-08-01" @default.
• W2005229058 modified "2023-10-18" @default.
• W2005229058 title "Density functional theory studies on structural isomers and bonding of catecholborane adducts of Group 5 metallocene (Nb, Ta) hydride complexes" @default.
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• W2005229058 doi "https://doi.org/10.1016/s0022-328x(03)00311-5" @default.
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