Information card for entry 7047398

Structure parameters

• Formula: C29 H41 Cf N6 S6
• Calculated formula: C29 H39 Cf N6 S6
• Title of publication: A series of dithiocarbamates for americium, curium, and californium.
• Authors of publication: Cary, Samantha K.; Su, Jing; Galley, Shane S.; Albrecht-Schmitt, Thomas E; Batista, Enrique R.; Ferrier, Maryline G.; Kozimor, Stosh A.; Mocko, Veronika; Scott, Brian L.; Van Alstine, Cayla E.; White, Frankie D.; Yang, Ping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 41
• Pages of publication: 14452 - 14461
• a: 10.436 ± 0.0012 Å
• b: 34.561 ± 0.004 Å
• c: 11.3259 ± 0.0014 Å
• α: 90°
• β: 117.142 ± 0.003°
• γ: 90°
• Cell volume: 3635.2 ± 0.8 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0848
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1231
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No