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Information card for entry 4123237
Preview
Coordinates | 4123237.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C147 H114 Au19 Cl6 F12 N3 O0 P6 Sb2 |
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Calculated formula | C147 H114 Au19 Cl6 F6 N3 P6 Sb |
SMILES | [Au]1234567[Au]89%10[Au]([C]%11#[C](c%12ccccc%12)[Au]%11[C]%11#[C](c%12ccccc%12)[Au]4%11)([C]4#[C](c%11ccccc%11)[Au]14)[Au]12%10[P](N[P]([Au]1([Au]1[P](N[P]([Au]21[Au]9([P](N[P]8(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[Au]2([C]1#[C](c2ccccc2)[Au]1[C]1#[C](c2ccccc2)[Au]31)[C]1#[C](c2ccccc2)[Au]71)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[Au]([C]1#[C](c2ccccc2)[Au]1[C]1#[C](c2ccccc2)[Au]51)[C]1#[C](c2ccccc2)[Au]61)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl.F[Sb]([F-])(F)(F)(F)F.C(Cl)Cl.C(Cl)Cl |
Title of publication | Au19 nanocluster featuring a v-shaped alkynyl-gold motif. |
Authors of publication | Wan, Xian-Kai; Tang, Qing; Yuan, Shang-Fu; Jiang, De-En; Wang, Quan-Ming |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2015 |
Journal volume | 137 |
Journal issue | 2 |
Pages of publication | 652 - 655 |
a | 20.323 ± 0.0003 Å |
b | 20.323 ± 0.0003 Å |
c | 31.8618 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 11396.6 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 9 |
Space group number | 146 |
Hermann-Mauguin space group symbol | R 3 :H |
Hall space group symbol | R 3 |
Residual factor for all reflections | 0.0384 |
Residual factor for significantly intense reflections | 0.0352 |
Weighted residual factors for significantly intense reflections | 0.0896 |
Weighted residual factors for all reflections included in the refinement | 0.0924 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation wavelength | 0.71073 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/4123237.html
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