Information card for entry 7038068

Structure parameters

• Formula: C18 H20 N2 O2 Se2
• Calculated formula: C18 H20 N2 O2 Se2
• SMILES: [Se]([Se]c1ccccc1C(=O)N(C)C)c1ccccc1C(=O)N(C)C
• Title of publication: Synthesis and structural characterization of monomeric mercury(ii) selenolate complexes derived from 2-phenylbenzamide ligands.
• Authors of publication: Patel, Saket; Meenakshi, ?; Hodage, Ananda S.; Verma, Ajay; Agrawal, Shailendra; Yadav, Abhimanyu; Kumar, Sangit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 9
• Pages of publication: 4030 - 4040
• a: 14.2781 ± 0.0007 Å
• b: 12.1561 ± 0.0006 Å
• c: 11.4422 ± 0.0005 Å
• α: 90°
• β: 113.62°
• γ: 90°
• Cell volume: 1819.6 ± 0.15 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0771
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No