Information card for entry 7107416

Structure parameters

• Formula: C12 H14 Ag Cl N4 O5
• Calculated formula: C12 H14 Ag Cl N4 O5
• Title of publication: Guest-induced crystal-to-crystal expansion and contraction of a 3-D porous coordination polymer
• Authors of publication: Witold Bloch; Christopher Sumby
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 2534
• a: 28.3534 ± 0.0015 Å
• b: 28.3534 ± 0.0015 Å
• c: 13.9544 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 9715.2 ± 1.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.205
• Residual factor for significantly intense reflections: 0.1306
• Weighted residual factors for significantly intense reflections: 0.3826
• Weighted residual factors for all reflections included in the refinement: 0.4174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No