Information card for entry 7203986

Structure parameters

• Formula: C16.875 H12 Fe0.375 N2.25 O6.375 S6
• Calculated formula: C16.875 H12 Fe0.375 N2.25 O6.375 S6
• Title of publication: A new stable organic metal based on the BEDO-TTF donor and the doubly charged nitroprusside anion, (BEDO-TTF)4[Fe(CN)5NO]
• Authors of publication: Zorina, Leokadiya V.; Khasanov, Salavat S.; Shibaeva, Rimma P.; Gener, Marc; Rousseau, Roger; Canadell, Enric; Kushch, Lyudmila A.; Yagubskii, Eduard B.; Drozdova, Olga O.; Yakushi, Kyuya
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2000
• Journal volume: 10
• Journal issue: 9
• Pages of publication: 2017
• a: 4.0251 ± 0.0003 Å
• b: 15.266 ± 0.002 Å
• c: 19.259 ± 0.002 Å
• α: 97.02 ± 0.01°
• β: 93.23 ± 0.01°
• γ: 96.04 ± 0.01°
• Cell volume: 1165.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0753
• Residual factor for significantly intense reflections: 0.0707
• Weighted residual factors for significantly intense reflections: 0.2303
• Weighted residual factors for all reflections included in the refinement: 0.2383
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No