Information card for entry 7202315

Structure parameters

• Common name: tris(acetonitrile)chlorobis(tris(4-(3-pyridyl)phenylester) cyclotriguaiacylene)-trisilver(i) tetrafluoroborate acetonitrile clathrate
• Chemical name: tris(acetonitrile)chlorobis(tris{4-(3-pyridyl)phenylester) cyclotriguaiacylene)- trisilver(I) tetrafluoroborate acetonitrile clathrate
• Formula: C132 H108 Ag3 B2 Cl F8 N12 O18
• Calculated formula: C131.96 H90 Ag3 Cl N12 O18
• Title of publication: Extended 36 and 63 arrays of capsule motifs using ligand tris{4-(3-pyridyl)phenylester}cyclotriguaiacylene
• Authors of publication: Ronson, Tanya K.; Hardie, Michaele J.
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 1731
• a: 16.1966 ± 0.0004 Å
• b: 16.1966 ± 0.0004 Å
• c: 34.0682 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7739.8 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.129
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.2991
• Weighted residual factors for all reflections included in the refinement: 0.3413
• Goodness-of-fit parameter for all reflections included in the refinement: 1.319
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No