Information card for entry 7205572

Structure parameters

• Formula: C39 H64 N17 O15 S4
• Calculated formula: C39 H64 N17 O15 S4
• Title of publication: Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks
• Authors of publication: Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 7
• Pages of publication: 2204
• a: 7.372 ± 0.0016 Å
• b: 16.324 ± 0.004 Å
• c: 24.346 ± 0.005 Å
• α: 72.595 ± 0.004°
• β: 89.618 ± 0.004°
• γ: 85.998 ± 0.004°
• Cell volume: 2788.5 ± 1.1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1498
• Residual factor for significantly intense reflections: 0.0713
• Weighted residual factors for significantly intense reflections: 0.1732
• Weighted residual factors for all reflections included in the refinement: 0.2144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No