Information card for entry 2224084

Structure parameters

• Chemical name: Tris(<i>N</i>-benzyl-<i>N</i>-methyldithiocarbamato- κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')europium(III)
• Formula: C39 H38 Eu N5 S6
• Calculated formula: C39 H38 Eu N5 S6
• SMILES: [Eu]1234([S]=C(S1)N(C)Cc1ccccc1)([S]=C(S2)N(C)Cc1ccccc1)(SC(=[S]3)N(C)Cc1ccccc1)[n]1c2c3[n]4cccc3ccc2ccc1
• Title of publication: Tris(<i>N</i>-benzyl-<i>N</i>-methyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')europium(III)
• Authors of publication: Baba, Ibrahim; Raya, Indah; Yamin, Bohari M.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1376
• a: 10.691 ± 0.001 Å
• b: 12.288 ± 0.001 Å
• c: 16.553 ± 0.002 Å
• α: 73.652 ± 0.002°
• β: 74.72 ± 0.002°
• γ: 71.629 ± 0.002°
• Cell volume: 1943.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1316
• Weighted residual factors for all reflections included in the refinement: 0.141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes