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Information card for entry 1508466
Preview
Coordinates | 1508466.cif |
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Original paper (by DOI) | HTML |
Formula | C17 H14 P Pd2 S20 |
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Calculated formula | C17 H14 P Pd2 S20 |
Title of publication | Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) |
Authors of publication | Kato, Reizo; Hengbo, Cui |
Journal of publication | Crystals |
Year of publication | 2012 |
Journal volume | 2 |
Journal issue | 3 |
Pages of publication | 861 - 874 |
a | 14.437 ± 0.004 Å |
b | 6.3614 ± 0.0015 Å |
c | 37.243 ± 0.009 Å |
α | 90° |
β | 96.938 ± 0.003° |
γ | 90° |
Cell volume | 3395.3 ± 1.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for significantly intense reflections | 0.0324 |
Weighted residual factors for all reflections included in the refinement | 0.082 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176435 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
1508466.cif |
120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1508466.cif |
69292 | 2012-12-07 | cif/ Adding structures of 1508466 via cif-deposit CGI script. |
1508466.cif |
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Users of the data should acknowledge the original authors of the
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