Reaction of Pentadienyl Complexes with Metal Carbonyls:  Synthetic, Structural, and Theoretical Studies of Metallabenzene π-Complexes

2003 ◽  
Vol 22 (2) ◽  
pp. 264-274 ◽  
Author(s):  
Ulrike Effertz ◽  
Ulli Englert ◽  
Frank Podewils ◽  
Albrecht Salzer ◽  
Trixie Wagner ◽  
...  
Keyword(s):  
Theoretical Studies ◽  
Metal Carbonyls

P2S2-Bridged binuclear metal carbonyls from dimerization of coordinated thiophosphoryl groups: a theoretical study

2020 ◽  
Vol 44 (30) ◽  
pp. 12942-12948
Author(s):  
Zhong Zhang ◽  
Zuqing Chen ◽  
Zhipeng Yang ◽  
Jianping Wang ◽  
Liang Pu ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Theoretical Studies ◽  
Metal Carbonyls ◽  
Binuclear Metal

Theoretical studies indicate the complexes M(CO)n(PS) with bent 1-e/2-e donor PS groups to be unstable for giving the stable M(CO)n−1(PS) with linear 3-e donor PS groups. In addition, only Mn2(CO)8(P2S2) is energetically viable from the Mn(CO)4(PS).

Photoelectron velocity-map imaging and theoretical studies of heteronuclear metal carbonyls MNi(CO)3− (M = Mg, Ca, Al)

2016 ◽  
Vol 144 (12) ◽  
pp. 124303 ◽  
Author(s):  
Hua Xie ◽  
Jinghan Zou ◽  
Qinqin Yuan ◽  
Hongjun Fan ◽  
Zichao Tang ◽  
...  
Keyword(s):  
Velocity Map Imaging ◽  
Theoretical Studies ◽  
Metal Carbonyls

Photoelectron Velocity-Map Imaging and Theoretical Studies of Heterotrinuclear Metal Carbonyls V2Ni(CO)n– (n = 6–10)

2017 ◽  
Vol 122 (1) ◽  
pp. 53-59 ◽  
Author(s):  
Jumei Zhang ◽  
Hua Xie ◽  
Gang Li ◽  
Xiangtao Kong ◽  
Hongjun Fan ◽  
...  
Keyword(s):  
Velocity Map Imaging ◽  
Theoretical Studies ◽  
Metal Carbonyls

scholarly journals Probing the microhydration of metal carbonyls: a photoelectron velocity-map imaging spectroscopic and theoretical study of Ni(CO)3(H2O)n−

2016 ◽  
Vol 18 (38) ◽  
pp. 26719-26724 ◽  
Author(s):  
Hua Xie ◽  
Jinghan Zou ◽  
Xiangtao Kong ◽  
Weiqing Zhang ◽  
Musahid Ahmed ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Velocity Map Imaging ◽  
Water Molecules ◽  
Theoretical Studies ◽  
Metal Carbonyls ◽  
Ring Network ◽  
Water Ring

Photoelectron spectroscopic and theoretical studies reveal that the water molecules prefer to form a water-ring network to solvate the carbonyl terminals.

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