Information card for entry 2003907

Structure parameters

• Formula: C34 H24 N2 O2 S2
• Calculated formula: C34 H24 N2 O2 S2
• SMILES: S(Sc1ccccc1/N=C/c1c2ccccc2ccc1O)c1c(/N=C/c2c(O)ccc3ccccc23)cccc1
• Title of publication: <i>N</i>,<i>N</i>'-[Dithiobis(<i>o</i>-phenylene)]bis(2-hydroxy-1-naphthaldimine)
• Authors of publication: Elmali, A.; Özbey, S.; Kendi, E.; Kabak, M.; Elerman, Y.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 9
• Pages of publication: 1878 - 1880
• a: 8.656 ± 0.001 Å
• b: 11.81 ± 0.01 Å
• c: 13.521 ± 0.001 Å
• α: 78.93 ± 0.02°
• β: 82.28 ± 0.01°
• γ: 86.13 ± 0.02°
• Cell volume: 1343 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for all reflections: 0.1159
• Weighted residual factors for significantly intense reflections: 0.1141
• Goodness-of-fit parameter for all reflections: 2.828
• Goodness-of-fit parameter for significantly intense reflections: 3.051
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No