Crystallography Open Database

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Searching journal of publication like 'Journal of Chemical Theory and Computation' volume of publication is 1

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1506342 CIFC22 H17 F6 N3 O3 P ReP 1 21/n 18.9203; 12.925; 21.104
90; 90.521; 90		2433.1Stoyanov, Stanislav R.; Villegas, John M.; Cruz, Arvin J.; Lockyear, Loranelle L.; Reibenspies, Joseph H.; Rillema, D. Paul
Computational and Spectroscopic Studies of Re(I) Bipyridyl Complexes Containing 2,6-Dimethylphenylisocyanide (CNx) Ligand
Journal of Chemical Theory and Computation, 2005, 1, 95

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All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.