Information card for entry 7045582

Structure parameters

• Chemical name: Fe0.85Se(C2H8N2)0.3
• Formula: C0.6 H2.4 Fe0.85 N0.6 Se
• Calculated formula: C0.666667 H2.66667 Fe0.85 N0.666667 Se
• Title of publication: Systematic dimensional reduction of the layered β-FeSe structure by solvothermal synthesis.
• Authors of publication: Stahl, J.; Shlaen, E.; Singer, H.; Johrendt, D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 10
• Pages of publication: 3264 - 3271
• a: 3.9037 ± 0.0005 Å
• b: 21.528 ± 0.002 Å
• c: 3.8585 ± 0.0006 Å
• α: 90°
• β: 91.34 ± 0.02°
• γ: 90°
• Cell volume: 324.18 ± 0.07 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Goodness-of-fit parameter for all reflections: 1.104
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No