Information card for entry 4309352

Structure parameters

• Common name: DippNAsCl Dimer
• Formula: C36 H46 As2 Cl2 N2
• Calculated formula: C36 H46 As2 Cl2 N2
• SMILES: [As]1(Cl)N([As](N1c1c(cccc1C(C)C)C(C)C)Cl)c1c(C(C)C)cccc1C(C)C.c1ccccc1.c1ccccc1
• Title of publication: Synthesis of cyclo-2,4,6-Triarsa-1,3,5-triazanes from cyclo-2,4-Diarsa-1,3-diazanes Demonstrating the General Influence of Substituent Steric Strain on the Relative Stability of Pnictazane Oligomers
• Authors of publication: Neil Burford; Jeff C. Landry; Michael J. Ferguson; Robert McDonald
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5897 - 5902
• a: 22.8454 ± 0.0016 Å
• b: 10.2167 ± 0.0007 Å
• c: 15.6939 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3663 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for significantly intense reflections: 0.0608
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No