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Information card for entry 7041894
Preview
| Coordinates | 7041894.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C19 H21 Au N2 O5 P |
|---|---|
| Calculated formula | C19 H21 Au N2 O5 P |
| SMILES | [Au]([P](c1occc1)(c1occc1)c1occc1)C1=N(=O)C(C([N]1=O)(C)C)(C)C |
| Title of publication | An efficient synthetic method for organometallic radicals: structures and properties of gold(i)-(nitronyl nitroxide)-2-ide complexes. |
| Authors of publication | Suzuki, Shuichi; Kira, Sayaka; Kozaki, Masatoshi; Yamamura, Masaki; Hasegawa, Toru; Nabeshima, Tatsuya; Okada, Keiji |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 8 |
| Pages of publication | 2653 - 2659 |
| a | 12.636 ± 0.01 Å |
| b | 12.676 ± 0.01 Å |
| c | 14.952 ± 0.011 Å |
| α | 66.34 ± 0.03° |
| β | 70.68 ± 0.04° |
| γ | 72.25 ± 0.03° |
| Cell volume | 2029 ± 3 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 200 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 significantly intense reflections | 0.0364 |
| Weighted residual factors for all reflections included in the refinement | 0.0294 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7041894.cif |
| 193794 | 2017-03-05 | cif/ Updating files of 7041894, 7041895, 7041896, 7041897, 7041898 Original log message: Adding full bibliography for 7041894--7041898.cif. |
7041894.cif |
| 191159 | 2017-01-31 | cif/ Adding structures of 7041894, 7041895, 7041896, 7041897, 7041898 via cif-deposit CGI script. |
7041894.cif |
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Users of the data should acknowledge the original authors of the
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