scholarly journals Cooperativity between hydrogen- and halogen bonds: the case of selenourea

2018 ◽  
Vol 20 (13) ◽  
pp. 8506-8514 ◽  
Author(s):  
Gianluca Ciancaleoni
Keyword(s):  
Theoretical Investigation ◽  
Halogen Bonds ◽  
Benzoate Anion

A combined experimental/theoretical investigation on the cooperativity between hydrogen- and halogen bonds is presented. In this study, it is shown that selenourea can interact at the same time with a benzoate anion and a polarized iodine, with the two interactions influencing and enhancing each other.

Ligand-driven formation of halogen bonds involving Au(i) complexes

2018 ◽  
Vol 42 (13) ◽  
pp. 10529-10538 ◽  
Author(s):  
Ferdinand Groenewald ◽  
Jan Dillen ◽  
Catharine Esterhuysen
Keyword(s):  
Theoretical Investigation ◽  
Halogen Bond ◽  
Halogen Bonds

A theoretical investigation shows that the Au(i) centre in a variety of complexes can behave as a halogen bond acceptor.

Wheel and Axle Topology Driven Halogen Bonds for the Construction of Molecular Arrays in Hexacoordinated Sn(IV)Porphyrins: A Structural and Theoretical Investigation

2019 ◽  
Vol 19 (2) ◽  
pp. 942-951 ◽  
Author(s):  
Sushila ◽  
P. Venugopalan ◽  
Ramesh Kataria ◽  
Dipak Kumar Das ◽  
Arvind Chaudhary ◽  
...  
Keyword(s):  
Theoretical Investigation ◽  
Halogen Bonds

THEORETICAL INVESTIGATION OF ISOMER SHIFTS IN Fe, FeAl, FeTi AND FeCo

1988 ◽  
Vol 49 (C8) ◽  
pp. C8-101-C8-102
Author(s):  
P. Blaha ◽  
K. Schwarz
Keyword(s):  
Theoretical Investigation

Theoretical Investigation of Concrete Beams Reinforced with Steel and Fiber Reinforced Polymer Bars

2017 ◽  
Author(s):  
Besian Sianani ◽  
Metin Hakan Severcan ◽  
Ilker Fatih Kara
Keyword(s):  
Theoretical Investigation ◽  
Concrete Beams ◽  
Fiber Reinforced Polymer ◽  
Fiber Reinforced ◽  
Reinforced Polymer

THEORETICAL INVESTIGATION OF THE SPRAY FROM A PRESSURIZED METERED-DOSE INHALER

1997 ◽  
Vol 7 (4) ◽  
pp. 417-436 ◽  
Author(s):  
C. A. Dunbar ◽  
J. F. Miller
Keyword(s):  
Theoretical Investigation ◽  
Dose Inhaler ◽  
Metered Dose Inhaler ◽  
Metered Dose ◽  
Pressurized Metered Dose Inhaler

Experimental and Theoretical Investigation of the Effect of Radiation and Combined Heat Transfer on Initiation and Spread of Ground Forest Fires

2002 ◽  
Vol 33 (7-8) ◽  
pp. 13
Author(s):  
A. M. Grishin ◽  
A. A. Dolgov ◽  
V. P. Zima ◽  
A. N. Subbotin ◽  
R. Sh. Tsvyk
Keyword(s):  
Heat Transfer ◽  
Theoretical Investigation ◽  
Forest Fires ◽  
Combined Heat Transfer
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