Information card for entry 2204391

Structure parameters

• Chemical name: Di(ethylendiamine-κ2N,N^'^)(thiosulfato-κS) copper(II)
• Formula: C4 H16 Cu N4 O3 S2
• Calculated formula: C4 H16 Cu N4 O3 S2
• SMILES: C1C[NH2][Cu]2([NH2]1)([NH2]CC[NH2]2)SS(=O)(=O)[O-]
• Title of publication: Bis(ethylenediamine-κ^2^<i>N,N</i>')(thiosulfato-κ<i>S</i>)copper(II)
• Authors of publication: Fu, Ai-Yun; Wang, Da-Qi; Wang, Fu-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: m1527 - m1529
• a: 6.613 ± 0.002 Å
• b: 11.858 ± 0.004 Å
• c: 13.936 ± 0.005 Å
• α: 90°
• β: 94.216 ± 0.004°
• γ: 90°
• Cell volume: 1089.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0919
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 0.934
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes