Information card for entry 4111186

Structure parameters

• Common name: Bis(acetonitrile)tetracyanoethanide(1-)iron(II) tetrachloroferrate(III)
• Formula: C10 H6 Cl4 Fe2 N6
• Calculated formula: C5 H3 Cl2 Fe N3
• Title of publication: Magnetic Ordering (Tc= 90 K) Observed for Layered [FeII(TCNE.-)(NCMe)2]+[FeIIICl4]- (TCNE = Tetracyanoethylene)
• Authors of publication: Konstantin I. Pokhodnya; Michael Bonner; Jae-Hyuk Her; Peter W. Stephens; Joel S. Miller
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 15592 - 15593
• a: 14.3327 ± 0.0001 Å
• b: 16.482 ± 0.0002 Å
• c: 7.28 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1719.77 ± 0.03 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n a m
• Hall space group symbol: -P 2c 2n
• Residual factor R(I) for significantly intense reflections: 0.012
• Goodness-of-fit parameter for all reflections: 1.277
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.690779 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No