Information card for entry 7011827

Structure parameters

• Formula: C3 H16 Cd2 N2 O14 S3
• Calculated formula: C3 H16 Cd2 N2 O14 S3
• Title of publication: Organically templated linear and layered cadmium sulfatesElectronic supplementary information (ESI) available: powder diffraction data for IV, view of I down the a-axis, the structure of II in the ac-plane and a polyhedral view of IV in the ab-plane. See http://www.rsc.org/suppdata/dt/b2/b204482j/
• Authors of publication: Paul, Geo; Choudhury, Amitava; Rao, C. N. R.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 20
• Pages of publication: 3859
• a: 8.3802 ± 0.0004 Å
• b: 8.6579 ± 0.0005 Å
• c: 11.3254 ± 0.0006 Å
• α: 84.926 ± 0.002°
• β: 72.414 ± 0.002°
• γ: 75.741 ± 0.002°
• Cell volume: 759.09 ± 0.07 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: 0.0494
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections: 0.0855
• Weighted residual factors for significantly intense reflections: 0.0809
• Goodness-of-fit parameter for all reflections: 0.949
• Goodness-of-fit parameter for significantly intense reflections: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No