Information card for entry 2200050

Structure parameters

• Common name: chlorobis[1,2-ethanediylbis(diphenylphosphine)-P,P'](thiocarbonyl-C)technetium
• Formula: C59 H54 Cl P4 S Tc
• Calculated formula: C59 H54 Cl P4 S Tc
• Title of publication: [TcCl(CS)(dppe)~2~]·C~6~H~6~
• Authors of publication: Bryan, Jeffrey C.; Burrell, Anthony K.; Kubas, Gregory J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 1
• Pages of publication: m23 - m24
• a: 10.3872 ± 0.001 Å
• b: 10.5518 ± 0.0009 Å
• c: 12.8953 ± 0.0011 Å
• α: 67.185 ± 0.006°
• β: 72.62 ± 0.009°
• γ: 83.849 ± 0.008°
• Cell volume: 1243.3 ± 0.2 ų
• Cell temperature: 203 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.24
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes