Information card for entry 4332194

Structure parameters

• Chemical name: Bis(N,N-diethylethylenediamine)copper(II) Perchlorate
• Formula: C6 H16 Cl Cu0.5 N2 O4
• Calculated formula: C6 H16 Cl Cu0.5 N2 O4
• Title of publication: Structural Basis for the Phase Switching of Bisaminecopper(II) Cations at the Thermal Limits of Lattice Stability
• Authors of publication: Naumov, Panče; Sakurai, Kenji; Asaka, Toru; Belik, Alexei A.; Adachi, Shin-ichi; Takahashi, Junichi; Koshihara, Shin-ya
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 13
• Pages of publication: 5027 - 5033
• a: 9.9546 ± 0.0014 Å
• b: 8.383 ± 0.0011 Å
• c: 13.289 ± 0.003 Å
• α: 90°
• β: 97.437 ± 0.002°
• γ: 90°
• Cell volume: 1099.6 ± 0.3 ų
• Cell temperature: 319 ± 2 K
• Ambient diffraction temperature: 319 ± 2 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: I 1 2 1
• Hall space group symbol: I 2y
• Residual factor for all reflections: 0.1383
• Residual factor for significantly intense reflections: 0.0821
• Weighted residual factors for significantly intense reflections: 0.1915
• Weighted residual factors for all reflections included in the refinement: 0.2176
• Goodness-of-fit parameter for all reflections included in the refinement: 0.81
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No