Geometries, electronic structures, and bonding properties of endohedral Group‐14 Zintl clusters TM@E10 (TM = Fe, Co, Ni; E = Ge, Sn, Pb)
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DOI: 10.1002/jcc.26838
Abstract: The geometries, electronic structures, and bonding properties of the title endohedral Zintl clusters have been studied by using ab initio calculations. [Fe@Ge10]4− and [Co@Ge10]3− have D5h‐symmetric pentagonal prismatic structure and [Fe@Sn10]4− adopts the C2v‐symmetric structure… read more here.
Keywords: electronic structures; structures bonding; geometries electronic; bonding properties ... See more keywords
Diarylpnictogenyldialkylalanes─Synthesis, Structures, Bonding Analysis, and CO2 Capture.
Sign Up to like & getrecommendations! Published in 2022 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.1c03494
Abstract: Several new diphenylamino- and diphenylphosphanyldialkylalanes are reported, which were characterized in solution and in the solid state, assisted by in-depth bonding analysis within the DFT framework. In the case of bulky alkyl substituents on the… read more here.
Keywords: diarylpnictogenyldialkylalanes synthesis; structures bonding; analysis; synthesis structures ... See more keywords
Structures, Bonding and Sensor Properties of Some Alkaline o-Phthalatocuprates
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DOI: 10.3390/ma14195548
Abstract: Comprehensive study of the structure and bonding of disodium, dipotassium and diammonium di-o-phthalatocuprates(II) dihydrates has been undertaken. The crystal structure of ammonium o-phthalatocuprate has been determined. The identity of structures of phthalatocuprate chains in potassium… read more here.
Keywords: sensor properties; alkaline phthalatocuprates; bonding sensor; properties alkaline ... See more keywords