Information card for entry 2240147

Structure parameters

• Chemical name: <i>trans</i>-Aqua(perchlorato-κ<i>O</i>)bis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) perchlorate
• Formula: C6 H22 Cl2 Cu N4 O9
• Calculated formula: C6 H22 Cl2 Cu N4 O9
• Title of publication: Crystal structure of <i>trans</i>-aqua(perchlorato-κ<i>O</i>)bis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) perchlorate
• Authors of publication: Govindaraj, J.; Rajkumar, K.; Ganeshraja, A. S.; Anbalagan, K.; SubbiahPandi, A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 11
• Pages of publication: 438 - 440
• a: 7.8563 ± 0.0004 Å
• b: 14.2936 ± 0.0006 Å
• c: 14.8769 ± 0.0007 Å
• α: 90°
• β: 100.022 ± 0.005°
• γ: 90°
• Cell volume: 1645.11 ± 0.14 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1265
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes