Information card for entry 7207744

Structure parameters

• Common name: MOLTECH ANJOU UMR CNRS 6200 2, bd Lavoisier 49045 Angers cedex France
• Chemical name: MOLTECH ANJOU UMR CNRS 6200 2, bd Lavoisier 49045 Angers cedex France
• Formula: C108 H180 Ag3 Cl3 Fe3 N9 O68 P18
• Calculated formula: C108 H180 Ag3 Cl3 Fe3 N9 O68 P18
• Title of publication: Cyanomethylene-bis(phosphonate) as ditopical ligand: stepwise formation of a 2-D heterometallic Fe(iii)‒Ag(i) coordination network
• Authors of publication: Maxim, Catalin; Branzea, Diana; Allain, Magali; Andruh, Marius; Clérac, Rodolphe; Iorga, Bogdan I.; Avarvari, Narcis
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 9
• Pages of publication: 3096
• a: 20.403 ± 0.008 Å
• b: 26.51 ± 0.01 Å
• c: 30.721 ± 0.004 Å
• α: 90°
• β: 99.49 ± 0.02°
• γ: 90°
• Cell volume: 16389 ± 9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.3343
• Residual factor for significantly intense reflections: 0.1041
• Weighted residual factors for significantly intense reflections: 0.1867
• Weighted residual factors for all reflections included in the refinement: 0.2684
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No