Information card for entry 7045189

Structure parameters

• Formula: C43 H52 Ag3 N7 O10 Se2
• Calculated formula: C43 H52 Ag3 N7 O10 Se2
• SMILES: [Ag]1[Se](=C2N(C=CN2c2c(cc(cc2C)C)C)c2c(cc(cc2C)C)C)[Ag]2(ON(=O)=O)[O]([Ag]3([Se]1=C1N(C=CN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)ON(=[O]3)=O)N(=[O]2)=O.OC
• Title of publication: Diverse silver(i) coordination chemistry with cyclic selenourea ligands.
• Authors of publication: Perras, Justin H.; Mezibroski, Stefan M. J.; Wiebe, Matthew A.; Ritch, Jamie S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 5
• Pages of publication: 1471 - 1478
• a: 31.152 ± 0.004 Å
• b: 8.5271 ± 0.0012 Å
• c: 18.229 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4842.3 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.152
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No