Information card for entry 7233635

Structure parameters

• Formula: C6 H32 Fe Mo6 N3 O25
• Calculated formula: C6 H19 Fe Mo6 N3 O25
• Title of publication: New photoresponsive charge-transfer spiropyran/polyoxometalate assemblies with highly tunable optical properties
• Authors of publication: Khadija Hakouk; Olivier Oms; Anne Dolbecq; Jerome Marrot; Ali Saad; Pierre Mialane; Houda El Bekkachi; Stephane Jobic; Philippe Deniard; Remi Dessapt
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2014
• Journal volume: 2
• Pages of publication: 1628 - 1641
• a: 11.157 ± 0.004 Å
• b: 11.733 ± 0.004 Å
• c: 22.906 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2998.5 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.1494
• Residual factor for significantly intense reflections: 0.0752
• Weighted residual factors for significantly intense reflections: 0.1581
• Weighted residual factors for all reflections included in the refinement: 0.1915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No