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Symmetry-constrained force fields in the prediction of molecular geometries of metal complexes. I

โœ Scribed by Dwyer, Mark; Geue, Rodney J.; Snow, Michael R.


Book ID
127329242
Publisher
American Chemical Society
Year
1973
Tongue
English
Weight
706 KB
Volume
12
Category
Article
ISSN
0020-1669

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A molecular mechanics force field for rh
โœ Lamprecht, Delanie; Lamprecht, Gert J. ๐Ÿ“‚ Article ๐Ÿ“… 2000 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 280 KB ๐Ÿ‘ 2 views

The main purpose of the development of an Rh(I) Carbonyl Phosphine force field was to predict the molecular structure of Rh(I) complexes as well as to compute possible intermediates or transition states during the oxidative addition of CH 3 I to these complexes.