Information card for entry 7007909

Structure parameters

• Formula: C29 H35 Cl13 Fe N6 O4 Pt2 S2
• Calculated formula: C29 H31 Cl13 Fe N6 O4 Pt2 S2
• SMILES: c1cccc2c3cccc[n]3[Fe]3(C#[N][Pt](Cl)(Cl)[S](C)(C)=O)(C#[N][Pt](Cl)(Cl)[S](C)(C)=O)([n]12)[n]1ccccc1c1cccc[n]31.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.O.O
• Title of publication: Design and synthesis of heterobimetallic donor-acceptor chemodosimetric ensembles for the detection of sulfhydryl-containing amino acids and peptides.
• Authors of publication: Chow, Cheuk-Fai; Lam, Michael H. W.; Sui, Hongyan; Wong, Wai-Yeung
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 3
• Pages of publication: 475 - 484
• a: 13.123 ± 0.008 Å
• b: 13.681 ± 0.008 Å
• c: 15.542 ± 0.009 Å
• α: 74.26 ± 0.01°
• β: 68.828 ± 0.01°
• γ: 76.081 ± 0.011°
• Cell volume: 2473 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0951
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.182
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No