Information card for entry 2210037

Structure parameters

• Chemical name: Tetra-μ~2~-acetato-bis{1-[5-(dimethylamino)naphthylsulfonyl]imidazole- κN^3^]rhodium} (Rh—Rh) acetonitrile disolvate
• Formula: C42 H48 N8 O12 Rh2 S2
• Calculated formula: C42 H48 N8 O12 Rh2 S2
• SMILES: c1n(cc[n]1[Rh]1234[O]=C(C)O[Rh]4([n]4cn(cc4)S(=O)(=O)c4cccc5c(N(C)C)cccc45)([O]=C(C)O1)(OC(=[O]3)C)[O]=C(C)O2)S(=O)(=O)c1cccc2c1cccc2N(C)C.N#CC.C(#N)C
• Title of publication: Tetra-μ~2~-acetato-bis({1-[5-(dimethylamino)naphthylsulfonyl]imidazole-κ<i>N</i>^3^}rhodium)(<i>Rh</i>—<i>Rh</i>) acetonitrile disolvate
• Authors of publication: Löffler, Philipp M. G.; Petersen, Henrik H.; Skovsgaard, Signe; McKenzie, Christine J.; Bond, Andrew D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1808 - m1809
• a: 8.871 ± 0.0009 Å
• b: 25.256 ± 0.003 Å
• c: 10.9402 ± 0.001 Å
• α: 90°
• β: 109.195 ± 0.004°
• γ: 90°
• Cell volume: 2314.8 ± 0.4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes