Crystallography Open Database

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4001602 CIFC42.33 H52.67 Br Cl0.67 N O3P 6516.4176; 16.4176; 77.83
90; 90; 120		18167.6Melville, James L.; Lovelock, Kevin R. J.; Wilson, Claire; Allbutt, Bryan; Burke, Edmund K.; Lygo, Barry; Hirst, Jonathan D.
Exploring Phase-Transfer Catalysis with Molecular Dynamics and 3D/4D Quantitative Structure−Selectivity Relationships
Journal of Chemical Information and Modeling, 2005, 45, 971
5000124 CIFC14 H22 Cl2 N O1.5P -17.571; 9.31; 11.687
94.58; 101.49; 90.15		804.54Froimowitz, M.; George, C.
Conformational Analysis and a Crystal Structure of Bupropion, an Antidepressant with Dopamine Reuptake Blocking Activity
Journal of Chemical Information and Modeling, 1998, 38, 506-510

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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.