Information card for entry 2008116

Structure parameters

• Formula: C18 H19 N O2 S2
• Calculated formula: C18 H19 N O2 S2
• SMILES: COCn1c2ccccc2c2c1C1(SCCS1)C/C(=C\C)C2=O
• Title of publication: 9-Acetonyl-3-ethylidene-1,2,3,4-tetrahydrospiro[carbazole-1,2'-[1,3]dithiolan]-4-one
• Authors of publication: Hökelek, Tuncer; Patır, Süleyman; Uludağ, Nesi̇mi̇
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: 114 - 116
• a: 9.202 ± 0.001 Å
• b: 18.87 ± 0.003 Å
• c: 19.138 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3323.2 ± 0.7 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.048
• Goodness-of-fit parameter for significantly intense reflections: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No