Information card for entry 8101882

Structure parameters

• Chemical name: bis(1,10-phenanthroline)bis(2,4-dimethylbenzoato)tetrakis(μ-2,4- dimethylbenzoato-O,O')disamarium(III)
• Formula: C78 H70 N4 O12 Sm2
• Calculated formula: C78 H70 N4 O12 Sm2
• Title of publication: Crystal structure of bis(1,10-phenanthroline-N,N')bis(2,4-dimethylbenzoato- O,O')tetrakis(μ-2,4-dimethylbenzoato-O,O')disamarium(III), Sm~2~(C~9~H~9~O~2~)~6~(C~12~H~8~N~2~)~2~
• Authors of publication: Zhang, T.-T.; Li, X.; Ju, Y.-L.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 1
• Pages of publication: 9 - 11
• a: 27.523 ± 0.003 Å
• b: 15.6987 ± 0.0015 Å
• c: 16.0479 ± 0.0015 Å
• α: 90°
• β: 101.123 ± 0.002°
• γ: 90°
• Cell volume: 6803.7 ± 1.2 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0626
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No