Information card for entry 2010059

Structure parameters

• Formula: C24 H18 Er N9 O24 S3
• Calculated formula: C24 H18 Er N9 O24 S3
• Title of publication: Isomorphous compounds [Nd(TDTD)~1.5~(pic)~3~] and [Er(TDTD)~1.5~(pic)~3~] (pic = picrate, TDTD = <i>trans</i>-1,4-dithiane <i>S</i>,<i>S</i>'-dioxide)
• Authors of publication: Ayala, J.D.; Vicentini, G.; Del Pra, A.; Bombieri, G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 9
• Pages of publication: 1458 - 1461
• a: 12.735 ± 0.005 Å
• b: 16.967 ± 0.004 Å
• c: 17.354 ± 0.002 Å
• α: 90°
• β: 111.11 ± 0.02°
• γ: 90°
• Cell volume: 3498.1 ± 1.7 ų
• Cell temperature: 298 K
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.048
• Goodness-of-fit parameter for significantly intense reflections: 1.84
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No