Information card for entry 1515304

Structure parameters

• Formula: C52 H88 Ag4 I8 N4
• Calculated formula: C52 H88 Ag4 I8 N4
• SMILES: I[Ag]1[I][Ag]2([I]1)[I][Ag]1([I]2)[I][Ag]([I]1)I.[N+](Cc1ccccc1)(CC)(CC)CC.[N+](CC)(CC)(CC)Cc1ccccc1.[N+](Cc1ccccc1)(CC)(CC)CC.[N+](Cc1ccccc1)(CC)(CC)CC
• Title of publication: Simplifying the growth of hybrid single-crystals by using nanoparticle precursors: the case of AgI.
• Authors of publication: Xu, Biao; Wang, Ruji; Wang, Xun
• Journal of publication: Nanoscale
• Year of publication: 2012
• Journal volume: 4
• Journal issue: 8
• Pages of publication: 2713 - 2719
• a: 10.0164 ± 0.0008 Å
• b: 12.4022 ± 0.0009 Å
• c: 14.8694 ± 0.001 Å
• α: 89.2116 ± 0.0019°
• β: 73.399 ± 0.002°
• γ: 73.308 ± 0.002°
• Cell volume: 1690.9 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.1152
• Residual factor for significantly intense reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.1044
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.223
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No