Information card for entry 4511736

Structure parameters

• Common name: Ag,Mn-2-mercaptonicotinic acid
• Formula: C36 H18 Ag6 Mn2 N6 O37 S6
• Calculated formula: C36 H18 Ag6 Mn2 N6 O37 S6
• Title of publication: Stepwise Crystallization: Illustrative Examples of the Use of Metalloligands [Cu6(mna)6]6‒and [Ag6(Hmna)2(mna)4]4‒(H2mna= 2-Mercapto Nicotinic Acid) in the Formation of Heterometallic Two- and Three-Dimensional Assemblies withbrucite,pcu, andsqlTopologies
• Authors of publication: Kundu, Tanaya; Jana, Ajay Kumar; Natarajan, Srinivasan
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 9
• Pages of publication: 4531
• a: 22.5369 ± 0.0005 Å
• b: 12.3093 ± 0.0002 Å
• c: 25.3732 ± 0.0005 Å
• α: 90°
• β: 107.09 ± 0.002°
• γ: 90°
• Cell volume: 6728.1 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0481
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.1072
• Weighted residual factors for all reflections included in the refinement: 0.1113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No