Information card for entry 2230199

Structure parameters

• Chemical name: Triethylammonium bis{2-[(2-oxido-5-nitrobenzylidene)amino]benzoato}ferrate(III) monohydrate
• Formula: C34 H32 Fe N5 O11
• Calculated formula: C34 H32 Fe N5 O11
• Title of publication: Triethylammonium bis{2-[(2-oxido-5-nitrobenzylidene)amino]benzoato}ferrate(III) monohydrate
• Authors of publication: Chygorin, Eduard N.; Petrusenko, Svetlana R.; Kokozay, Volodymyr N.; Smal, Yuri O.; Bon, Volodymyr V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: m593 - m594
• a: 10.2688 ± 0.0003 Å
• b: 14.7128 ± 0.0004 Å
• c: 25.08 ± 0.0007 Å
• α: 90°
• β: 97.23 ± 0.002°
• γ: 90°
• Cell volume: 3759.03 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0931
• Residual factor for significantly intense reflections: 0.0814
• Weighted residual factors for significantly intense reflections: 0.2337
• Weighted residual factors for all reflections included in the refinement: 0.242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes