Information card for entry 7012394

Structure parameters

• Formula: C19 H26 Cl N8 O Re S2
• Calculated formula: C19 H26 Cl N8 O Re S2
• SMILES: [Re]1234([n]5ccccc5C(C)=[N]1N=C(S2)NC)[n]1ccccc1C(C)=[N]3N=C(S4)NC.[Cl-].OC
• Title of publication: Synthesis and characterisation of new homoleptic rhenium thiosemicarbazone complexes
• Authors of publication: Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Woollard-Shore, John
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 4
• Pages of publication: 748
• a: 12.8385 ± 0.0005 Å
• b: 8.5154 ± 0.0003 Å
• c: 22.3598 ± 0.0008 Å
• α: 90°
• β: 96.2545 ± 0.0017°
• γ: 90°
• Cell volume: 2429.93 ± 0.15 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for all reflections included in the refinement: 0.0461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No