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Information card for entry 4129016
Preview
Coordinates | 4129016.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C189 H162 Au13 Cl3 F12 N18 P2 |
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Calculated formula | C189 H162 Au13 Cl3 F12 N18 P2 |
SMILES | [Au]123456789%10%11[Au]%12%13%14([Au]%15%16%172([Au]2%18%191([Au]1%203%15([Au]34%12%16([Au]451([Au]1%10%143([Au]359([Au]6%13%172([Au]28%193([Au]7%18%20([Au]%114152=C1N(c2ccccc2N1Cc1ccccc1)Cc1ccccc1)Cl)=C1N(c2ccccc2N1Cc1ccccc1)Cc1ccccc1)Cl)=C1N(c2c(N1Cc1ccccc1)cccc2)Cc1ccccc1)=C1N(c2c(N1Cc1ccccc1)cccc2)Cc1ccccc1)=C1N(c2c(N1Cc1ccccc1)cccc2)Cc1ccccc1)Cl)=C1N(c2ccccc2N1Cc1ccccc1)Cc1ccccc1)=C1N(c2ccccc2N1Cc1ccccc1)Cc1ccccc1)=C1N(c2c(N1Cc1ccccc1)cccc2)Cc1ccccc1)=C1N(c2ccccc2N1Cc1ccccc1)Cc1ccccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Robust, Highly Luminescent Au<sub>13</sub> Superatoms Protected by N-Heterocyclic Carbenes. |
Authors of publication | Narouz, Mina R.; Takano, Shinjiro; Lummis, Paul A.; Levchenko, Tetyana I.; Nazemi, Ali; Kaappa, Sami; Malola, Sami; Yousefalizadeh, Goonay; Calhoun, Larry A.; Stamplecoskie, Kevin G.; Häkkinen, Hannu; Tsukuda, Tatsuya; Crudden, Cathleen M. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2019 |
Journal volume | 141 |
Journal issue | 38 |
Pages of publication | 14997 - 15002 |
a | 17.019 ± 0.003 Å |
b | 19.261 ± 0.003 Å |
c | 28.579 ± 0.004 Å |
α | 93.223 ± 0.005° |
β | 100.749 ± 0.005° |
γ | 90.782 ± 0.003° |
Cell volume | 9187 ± 3 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0962 |
Residual factor for significantly intense reflections | 0.0805 |
Weighted residual factors for significantly intense reflections | 0.2 |
Weighted residual factors for all reflections included in the refinement | 0.2134 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4129016.html
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