Information card for entry 2004132

Structure parameters

• Formula: C11 H18 N4 S3
• Calculated formula: C11 H18 N4 S3
• Title of publication: 2,3-Diethyl-5,6,7,8-tetrahydro-2aλ^4^-thia-2,3,4a,8a-tetraazacyclopent[<i>cd</i>]azulene-1(2<i>H</i>),4(3<i>H</i>)-dithione
• Authors of publication: Billing, D. G.; Boeyens, J. C. A.; Lai, L.-L.; Reid, D. H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 11
• Pages of publication: 2354 - 2356
• a: 5.615 ± 0.002 Å
• b: 10.0655 ± 0.001 Å
• c: 13.0482 ± 0.001 Å
• α: 90°
• β: 100.13 ± 0.02°
• γ: 90°
• Cell volume: 726 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Goodness-of-fit parameter for significantly intense reflections: 0.946
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No