Information card for entry 2313036

Structure parameters

• Chemical name: 1-(Furan-2-yl)-2-(thiophene-2-carbonyl)-3-(thiophen-2-yl)-2,3,3a,8a-tetrahydrocyclopenta[<i>a</i>]inden-8(1<i>H</i>)-one
• Formula: C25 H18 O3 S2
• Calculated formula: C25 H18 O3 S2
• Title of publication: Crystal structure and Hirshfeld surface analysis of 1-(furan-2-yl)-2-(thio-phene-2-carbon-yl)-3-(thio-phen-2-yl)-2,3,3a,8a-tetra-hydro-cyclo-penta-[<i>a</i>]inden-8(1<i>H</i>)-one.
• Authors of publication: Gezegen, Hayreddin; Ordu, Gamze; Atioğlu, Zeliha; Akkurt, Mehmet; Hamouda, Hamouda Adam
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: Pt 6
• Pages of publication: 697 - 701
• a: 6.2444 ± 0.0004 Å
• b: 10.157 ± 0.0006 Å
• c: 17.1745 ± 0.0011 Å
• α: 96.604 ± 0.005°
• β: 94.982 ± 0.005°
• γ: 99.812 ± 0.005°
• Cell volume: 1059.9 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.102
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1139
• Weighted residual factors for all reflections included in the refinement: 0.1408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No