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D 5 h Cu 5 H 5 X: Pentagonal Hydrocopper Cu 5 H 5 Containing Pentacoordinate Planar Nonmetal Centers (X = B, C, N, O)
Author(s) -
Li SiDian,
Miao ChangQing,
Ren GuangMing
Publication year - 2004
Publication title -
european journal of inorganic chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.667
H-Index - 136
eISSN - 1099-0682
pISSN - 1434-1948
DOI - 10.1002/ejic.200400223
Subject(s) - chemistry , crystallography , planar , density functional theory , carbon fibers , copper , catalysis , nanotechnology , computational chemistry , organic chemistry , materials science , computer graphics (images) , composite number , computer science , composite material
Pentacoordinate planar nonmetals (PPNs) centered in perfect pentagonal hydrocopper complexes Cu 5 H 5 X (X = B, C, N, O), as determined by density functional theory methods, are presented in this communication. The results obtained in this work complete the hypercoordinate planar carbon series with high symmetries ( D 4 h , D 5 h , and D 6 h ), and may shed new insight in catalyst chemistry. (© Wiley‐VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2004)