Information card for entry 4323479

Structure parameters

• Common name: compound 9
• Formula: C12 H12 Cl2 N Sb
• Calculated formula: C12 H12 Cl2 N Sb
• SMILES: [Sb]1(Cl)(Cl)[N](c2cccc3cccc1c23)(C)C
• Title of publication: Synthesis and Structures of Intramolecularly Base-Coordinated Group 15 Aryl Halides
• Authors of publication: Claire J. Carmalt; Alan H. Cowley; Robert D. Culp; Richard A. Jones; Smuruthi Kamepalli; Nicholas C. Norman
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 2770 - 2776
• a: 9.714 ± 0.0013 Å
• b: 10.0196 ± 0.0011 Å
• c: 13.444 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1308.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0835
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for all reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.0588
• Goodness-of-fit parameter for all reflections: 1.074
• Goodness-of-fit parameter for significantly intense reflections: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No