Information card for entry 4349400

Structure parameters

• Chemical name: 1-chloro-N-(chloro(phenyl)phosphanyl)-N-methyl-1-phenylphosphanamine
• Formula: C13 H13 Cl2 N P2
• Calculated formula: C13 H13 Cl2 N P2
• SMILES: ClP(N(P(Cl)c1ccccc1)C)c1ccccc1
• Title of publication: Nitrogen-Phosphorus(III)-Chalcogen Macrocycles for the Synthesis of Polynuclear Silver(I) Sandwich Complexes.
• Authors of publication: Yogendra, Sivathmeehan; Hennersdorf, Felix; Weigand, Jan J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 15
• Pages of publication: 8698 - 8704
• a: 7.10824 ± 0.00007 Å
• b: 13.14264 ± 0.00013 Å
• c: 15.5152 ± 0.00017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1449.45 ± 0.03 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 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: 0.0252
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0656
• Weighted residual factors for all reflections included in the refinement: 0.0661
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No