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Information card for entry 1572413
Preview
| Coordinates | 1572413.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H60 Cl4 In2 N2 O34 Rh12 |
|---|---|
| Calculated formula | C54 H60 Cl4 In2 N2 O34 Rh12 |
| SMILES | C(#[O])[Rh]12345(C#[O])[C]6(=O)[Rh]7894(C#[O])([C]4(=O)[Rh]%10%1127(C#[O])(C#[O])[In]21([Cl][In]17([Cl]2)(Cl)[Rh]2%12%13%14([C]%15(=O)[Rh]%16%17%18%13([C]%13(=O)[Rh]%1912%16(C#[O])(C#[O])[Rh]127%12(C#[O])(C#[O])[C]7(=O)[Rh]%14%15%171(C#[O])(C#[O])[Rh]%18%13%1927(C#[O])C#[O])(C#[O])C#[O])(C#[O])C#[O])(Cl)[Rh]123%10(C#[O])([C]3(=O)[Rh]84%111(C#[O])(C#[O])[Rh]56923(C#[O])C#[O])C#[O])C#[O].[N+](CC)(CC)(CC)CC.C1COCC1.O.[N+](CC)(CC)(CC)CC.C1CCCO1.O |
| Title of publication | Atomically precise rhodium-indium carbonyl nanoclusters: synthesis, characterization, crystal structure and electron-sponge features. |
| Authors of publication | Bussoli, Guido; Boccalini, Alberto; Bortoluzzi, Marco; Cesari, Cristiana; Iapalucci, Maria Carmela; Funaioli, Tiziana; Scorzoni, Giorgia; Zacchini, Stefano; Ruggieri, Silvia; Femoni, Cristina |
| Journal of publication | Nanoscale |
| Year of publication | 2024 |
| Journal volume | 16 |
| Journal issue | 38 |
| Pages of publication | 17852 - 17867 |
| a | 17.3907 ± 0.0018 Å |
| b | 10.053 ± 0.0011 Å |
| c | 22.894 ± 0.002 Å |
| α | 90° |
| β | 95.836 ± 0.003° |
| γ | 90° |
| Cell volume | 3981.8 ± 0.7 Å3 |
| Cell temperature | 76 ± 2 K |
| Ambient diffraction temperature | 76 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0801 |
| Residual factor for significantly intense reflections | 0.0611 |
| Weighted residual factors for significantly intense reflections | 0.1255 |
| Weighted residual factors for all reflections included in the refinement | 0.1326 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.144 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295300 (current) | 2024-10-06 | cif/ Updating files of 1572411, 1572412, 1572413, 1572414 Original log message: Adding full bibliography for 1572411--1572414.cif. |
1572413.cif |
| 294262 | 2024-08-29 | cif/ Adding structures of 1572411, 1572412, 1572413, 1572414 via cif-deposit CGI script. |
1572413.cif |
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Users of the data should acknowledge the original authors of the
structural data.