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Information card for entry 1004001
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| Coordinates | 1004001.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Tungsten sulfide cluster with tri-n- |
|---|---|
| Chemical name | octakis(mu!3$-sulfido)-hexakis(tri-n-butylphosphine)-hexa-tungsten |
| Formula | C72 H162 P6 S8 W6 |
| Calculated formula | C72 H162 P6 S8 W6 |
| Title of publication | Synthesis, Characterization, and Ligand Exchange Studies of W~6~S~8~L~6~ Cluster Compounds |
| Authors of publication | Jin, Song; Zhou, Ran; Scheuer, Ellen M.; Adamchuk, Jennifer; Rayburn, Lori L.; DiSalvo, Francis J. |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Journal issue | 12 |
| Pages of publication | 2666 - 2674 |
| a | 24.6648 ± 0.0012 Å |
| b | 19.8619 ± 0.0009 Å |
| c | 20.1365 ± 0.001 Å |
| α | 90° |
| β | 103.324 ± 0.001° |
| γ | 90° |
| Cell volume | 9599.1 ± 0.8 Å3 |
| Cell temperature | 163 ± 2 K |
| Ambient diffraction temperature | 163 ± 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 all reflections | 0.0396 |
| Residual factor for significantly intense reflections | 0.025 |
| Weighted residual factors for significantly intense reflections | 0.0506 |
| Weighted residual factors for all reflections included in the refinement | 0.059 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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