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Information card for entry 4001946
Preview
| Coordinates | 4001946.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H51 N2 S4 Sn |
|---|---|
| Calculated formula | C26 H54 N2 S4 Sn |
| SMILES | [Sn]1(SC(=[S]1)N(CCCC)CCCC)(SC(=S)N(CCCC)CCCC)(CCCC)CCCC |
| Title of publication | Organotin Dithiocarbamates: Single-Source Precursors for Tin Sulfide Thin Films by Aerosol-Assisted Chemical Vapor Deposition (AACVD) |
| Authors of publication | Ramasamy, Karthik; Kuznetsov, Vladimir L.; Gopal, Kandasamy; Malik, Mohammad A.; Raftery, James; Edwards, Peter P.; O'Brien, Paul |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2013 |
| Journal volume | 25 |
| Journal issue | 3 |
| Pages of publication | 266 - 276 |
| a | 20.345 ± 0.005 Å |
| b | 9.597 ± 0.005 Å |
| c | 34.35 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 91.27 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 6705 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0482 |
| Residual factor for significantly intense reflections | 0.0318 |
| Weighted residual factors for significantly intense reflections | 0.0755 |
| Weighted residual factors for all reflections included in the refinement | 0.0927 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Duplicate of | 4001715 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 218804 (current) | 2019-09-24 | cif/4/00/ Marked entry 4001946 as a duplicate of entry 4001715. |
4001946.cif |
| 218803 | 2019-09-24 | cif/4/00/ Updated bibliographic information in entries 4001713-4001715, 4001946. |
4001946.cif |
| 178377 | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4001946.cif |
| 169888 | 2015-10-30 | cif/4 Fixing Z values and formulae |
4001946.cif |
| 113190 | 2014-05-08 | cif/ Adding structures of 4001946 via cif-deposit CGI script. |
4001946.cif |
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