Information card for entry 7028795

Structure parameters

• Formula: C84 H116 F6 N8 O14 Rh2 S2
• Calculated formula: C68 H70 F6 N8 O7 Rh2 S2
• SMILES: [Rh]123456(n7c8ccccc8[n]8[Rh]9%10%11%12(n%13c([n]1c1ccccc%131)c78)([n]1cn(c7ccc(C=Cc8ccc(C=Cc%13ccc(n%14c[n]2cc%14)cc%13)cc8)cc7)cc1)[c]1([c]9([c]%10([c]%11([c]%121C)C)C)C)C)[c]1([c]3([c]4([c]5([c]61C)C)C)C)C.O=S(=O)([O-])C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F.CCOCC
• Title of publication: Design and self-assembly of variform organometallic macrocycle with terminal imidazole-based bridging ligands utilizing joints twist and rotation.
• Authors of publication: Wu, Tong; Lin, Yue-Jian; Jin, Guo-Xin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 6
• Pages of publication: 2356 - 2360
• a: 36.307 ± 0.003 Å
• b: 16.2368 ± 0.0014 Å
• c: 28.488 ± 0.002 Å
• α: 90°
• β: 123.135 ± 0.001°
• γ: 90°
• Cell volume: 14063 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1218
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1364
• Weighted residual factors for all reflections included in the refinement: 0.1599
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No