Information card for entry 4344469

Structure parameters

• Common name: (urea)2MnCl2
• Formula: C2 H8 Cl2 Mn N4 O2
• Calculated formula: C2 H8 Cl2 Mn N4 O2
• Title of publication: Magnetic Structure and Exchange Interactions in Quasi-One-Dimensional MnCl2(urea)2.
• Authors of publication: Manson, Jamie L.; Huang, Qing-Zhen; Brown, Craig M.; Lynn, Jeffrey W.; Stone, Matthew B.; Singleton, John; Xiao, Fan
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 24
• Pages of publication: 11897 - 11905
• a: 9.163 ± 0.0003 Å
• b: 12.5772 ± 0.0004 Å
• c: 7.3398 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 845.87 ± 0.04 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 45
• Hermann-Mauguin space group symbol: I b a 2
• Hall space group symbol: I 2 -2c
• Residual factor for all reflections: 0.0216
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0486
• Weighted residual factors for all reflections included in the refinement: 0.0493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No