SQUEEZE for treating severely disordered solvent molecules in the refinement of the otherwise ordered crystal structures of [Cd(C12H10N4)(C15H9O2)2(CH3OH)]·0.5H2O·CH3OH and [Cd(C12H10N4)1.5(C15H9O2)2]·CH3OH
In the refinement of the crystal structure of [Cd(C12H10N4)(C15H9O2)2(CH3OH)].0.5H2O.CH3OH, the lattice water molecule was not located by difference Fourier synthesis but was instead deduced by using SQUEEZE owing to severe disorder of the water molecule in the otherwise ordered crystal structure. ...
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| Format: | Article |
| Language: | English |
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Society of Chemists and Technologists of Macedonia
2015-05-01
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| Series: | Macedonian Journal of Chemistry and Chemical Engineering |
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| Online Access: | https://mjcce.org.mk/index.php/MJCCE/article/view/628 |