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Information card for entry 7204757
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Coordinates | 7204757.cif |
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Original paper (by DOI) | HTML |
Common name | (EDT-TTF-I2)2, PbI3, H20 |
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Chemical name | Bis(3,4-diiodo-3',4'-ethylenedithiotetrathiafulvalene), triiodolead(II), water |
Formula | C8 H4 I3.5 O0.5 Pb0.5 S6 |
Calculated formula | C8 H4 I3.5 O0.5 Pb0.5 S6 |
Title of publication | (EDT-TTF-I2)2PbI3�H2O: an ambient pressure metal with a ?? donor slab topologyElectronic supplementary information (ESI) available: indexed X-ray powder diagram and chemical analysis results for [(C2H5)4N]PbI3. See http://www.rsc.org/suppdata/jm/b3/b312493b/ |
Authors of publication | Devic, Thomas; Canadell, Enric; Auban-Senzier, Pascale; Batail, Patrick |
Journal of publication | Journal of Materials Chemistry |
Year of publication | 2004 |
Journal volume | 14 |
Journal issue | 2 |
Pages of publication | 135 |
a | 8.0312 ± 0.0016 Å |
b | 12.13 ± 0.002 Å |
c | 20.777 ± 0.004 Å |
α | 102.29 ± 0.03° |
β | 99.88 ± 0.03° |
γ | 100.13 ± 0.03° |
Cell volume | 1900.3 ± 0.7 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0496 |
Residual factor for significantly intense reflections | 0.0332 |
Weighted residual factors for significantly intense reflections | 0.0765 |
Weighted residual factors for all reflections included in the refinement | 0.0807 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.908 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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