Information card for entry 2300103

Structure parameters

• Formula: C18 H22 Cu N8 O6 S2
• Calculated formula: C18 H22 Cu N8 O6 S2
• Title of publication: Structure determination of nitrato-κ<i>O</i>-bis[2-(2-pyridyl-κ<i>N</i>)amino-5,6-dihydro-4<i>H</i>-1,3-thiazine-κ<i>N</i>]copper(II) nitrate <i>via</i> molecular modelling coupled with X-ray powder diffractometry
• Authors of publication: García-Cuesta, M. C.; Lozano, A. M.; Meléndez-Martínez, J. J.; Luna-Giles, F.; Ortiz, A. L.; González-Méndez, L. M.; Cumbrera, F. L.
• Journal of publication: Journal of Applied Crystallography
• Year of publication: 2004
• Journal volume: 37
• Journal issue: 6
• Pages of publication: 993 - 999
• a: 20.695 ± 0.007 Å
• b: 8.054 ± 0.002 Å
• c: 15.157 ± 0.004 Å
• α: 90°
• β: 112.09 ± 0.002°
• γ: 90°
• Cell volume: 2340.9 ± 1.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Diffraction radiation wavelength: 1.54183 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No