Information card for entry 7026663

Structure parameters

• Formula: C23 H21 Fe Hg N O S2
• Calculated formula: C23 H20.68 Fe Hg N O S2
• Title of publication: Efficient phenylmercury(II) methylferrocenyldithiocarbamate functionalized dye-sensitized solar cells.
• Authors of publication: Singh, Vikram; Chauhan, Ratna; Kumar, Abhinav; Bahadur, Lal; Singh, Nanhai
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 41
• Pages of publication: 9779 - 9788
• a: 17.726 ± 0.006 Å
• b: 12.386 ± 0.004 Å
• c: 9.581 ± 0.003 Å
• α: 90°
• β: 100.889 ± 0.005°
• γ: 90°
• Cell volume: 2065.7 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0957
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1702
• Weighted residual factors for all reflections included in the refinement: 0.2052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No