Information card for entry 7029045

Structure parameters

• Formula: C104 H110 N12 O22 P4 Sn6
• Calculated formula: C104 H110 N12 O22 P4 Sn6
• SMILES: c1(ccccc1/N=N/c1ccccc1)[Sn]1234[O]=P5(O[Sn]678([O]=P9(O[Sn]%10%11(c%12ccccc%12/N=N/c%12ccccc%12)([O]=P%12(O[Sn]%13([O]1[Sn](O6)([O]2)(c1ccccc1/N=N/c1ccccc1)(O%12)[O]=P(O%13)(O4)C1CCCCC1)([O]3)(O[Sn](O5)(O9)([O]7%10)([O]%11)c1ccccc1/N=N/c1ccccc1)c1ccccc1/N=N/c1ccccc1)C1CCCCC1)[O]8)C1CCCCC1)c1ccccc1/N=N/c1ccccc1)C1CCCCC1.C1CCCO1.C1CCCO1
• Title of publication: Assembly of hexa- and trinuclear monoorganostannoxanes: hemi-labile nature of intramolecular N→Sn coordination in RSnCl3 (R = 2-phenylazophenyl).
• Authors of publication: Metre, Ramesh K.; Mohapatra, Chandrajeet; Sahoo, Dipankar; Chandrasekhar, Vadapalli
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 8
• Pages of publication: 3364 - 3371
• a: 24.017 ± 0.005 Å
• b: 20.738 ± 0.005 Å
• c: 21.962 ± 0.005 Å
• α: 90 ± 0.005°
• β: 96.639 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 10865 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0871
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1131
• Weighted residual factors for all reflections included in the refinement: 0.1348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No