Information card for entry 7111044

Structure parameters

• Formula: C4 H4 Fe N8
• Calculated formula: C4 H4 Fe N8
• Title of publication: Crystal structure and metamagnetic property of a 2-D layered complex, [FeII(N3)2(pyz)]n (pyz = pyrazine)
• Authors of publication: Hao, Xiang; Wei, Yongge; Zhang, Shiwei
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 22
• Pages of publication: 2271
• a: 15.197 ± 0.003 Å
• b: 7.201 ± 0.001 Å
• c: 6.672 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 730.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0707
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for significantly intense reflections: 0.1648
• Weighted residual factors for all reflections included in the refinement: 0.1741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No