Information card for entry 4080991

Structure parameters

• Formula: C23 H32 Ge N2 O0.5 S Se
• Calculated formula: C23 H32 Ge N2 O0.5 S Se
• SMILES: C12=CC=CC=CC1=[N](CC(C)C)[Ge](N2CC(C)C)(Sc1ccccc1)=[Se].O1CCCC1
• Title of publication: Synthesis and Reactivity ofN-Aminotroponiminatogermylenepyrrole and Its Derivatives
• Authors of publication: Karwasara, Surendar; Sharma, Mahendra Kumar; Tripathi, Rupali; Nagendran, Selvarajan
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 14
• Pages of publication: 3830
• a: 14.7692 ± 0.0018 Å
• b: 13.5853 ± 0.0018 Å
• c: 23.728 ± 0.003 Å
• α: 90°
• β: 95.214 ± 0.003°
• γ: 90°
• Cell volume: 4741.2 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0219
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.0509
• Weighted residual factors for all reflections included in the refinement: 0.0515
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No