Crystallography Open Database

Result: there are 1301 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching journal of publication like 'Physical chemistry chemical physics : PCCP'

Blue left arrow Blue left arrow First | Blue left arrow Previous 5 | of 261 | Next 5 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
7206344 CIFC17 H18 N2 O2 SP -17.3605; 8.9292; 12.2136
94.491; 94.715; 100.07		784.16Cruz-Cabeza, Aurora J; Day, Graeme M.; Jones, William
Structure prediction, disorder and dynamics in a DMSO solvate of carbamazepine.
Physical chemistry chemical physics : PCCP, 2011, 13, 12808-12816
7206346 CIFC17 H18 N2 O2 SP -18.8708; 12.1901; 14.6128
94.97; 100.217; 95.036		1540.67Cruz-Cabeza, Aurora J; Day, Graeme M.; Jones, William
Structure prediction, disorder and dynamics in a DMSO solvate of carbamazepine.
Physical chemistry chemical physics : PCCP, 2011, 13, 12808-12816
7206347 CIFC17 H18 N2 O3 SP 1 21/n 110.6987; 12.4986; 11.9748
90; 91.067; 90		1600.98Cruz-Cabeza, Aurora J; Day, Graeme M.; Jones, William
Structure prediction, disorder and dynamics in a DMSO solvate of carbamazepine.
Physical chemistry chemical physics : PCCP, 2011, 13, 12808-12816
7206434 CIFC14 H10 N4P -16.7837; 8.7711; 10.7042
75.951; 71.904; 77.94		581.1Standara, Stanislav; Bouzková, Kateřina; Straka, Michal; Zacharová, Zuzana; Hocek, Michal; Marek, Jaromír; Marek, Radek
Interpretation of substituent effects on (13)C and (15)N NMR chemical shifts in 6-substituted purines.
Physical chemistry chemical physics : PCCP, 2011, 13, 15854-15864
7206435 CIFC13 H9 N5P 21 21 214.9475; 10.0332; 21.929
90; 90; 90		1088.5Standara, Stanislav; Bouzková, Kateřina; Straka, Michal; Zacharová, Zuzana; Hocek, Michal; Marek, Jaromír; Marek, Radek
Interpretation of substituent effects on (13)C and (15)N NMR chemical shifts in 6-substituted purines.
Physical chemistry chemical physics : PCCP, 2011, 13, 15854-15864

Blue left arrow Blue left arrow First | Blue left arrow Previous 5 | of 261 | Next 5 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
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.