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Information card for entry 4512909
Preview
| Coordinates | 4512909.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C264 H348 Ag20 N0 O8 |
|---|---|
| Calculated formula | C264 H348 Ag20 O8 |
| SMILES | [C]12(#Cc3cc(cc(c3)C(C)(C)C)C(C)(C)C)[Ag]34[O]=C(O[Ag]56[C]3([Ag][C]3(#Cc7cc(cc(c7)C(C)(C)C)C(C)(C)C)[Ag]78[C]9(#Cc%10cc(cc(c%10)C(C)(C)C)C(C)(C)C)[Ag][C]5(#Cc5cc(cc(c5)C(C)(C)C)C(C)(C)C)[Ag][C]5(#Cc%10cc(cc(c%10)C(C)(C)C)C(C)(C)C)[Ag]%10%11[O]=C(O[Ag]%12%13[C]%10([Ag][C]%10(#Cc%14cc(cc(c%14)C(C)(C)C)C(C)(C)C)[Ag]%14([C](#Cc%15cc(cc(c%15)C(C)(C)C)C(C)(C)C)([Ag][C]%12(#Cc%12cc(cc(c%12)C(C)(C)C)C(C)(C)C)[Ag]9)[Ag][C](#Cc9cc(cc(c9)C(C)(C)C)C(C)(C)C)([Ag]3([O]=C(O7)C)[C]4([Ag][C]68#Cc3cc(cc(c3)C(C)(C)C)C(C)(C)C)#Cc3cc(cc(c3)C(C)(C)C)C(C)(C)C)[Ag]1)[O]=C(O[Ag]%10([C](#Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C)([Ag]5)[Ag]2)[C]%11([Ag][C]%13%14#Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C)#Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C)C)#Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C)C)#Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C)C |
| Title of publication | Soluble Silver Acetylide for the Construction and Structural Conversion of All-Alkynyl-Stabilized High-Nuclearity Homoleptic Silver Clusters |
| Authors of publication | Zhang, Rui; Hao, Xiang; Li, Xiumin; Zhou, Zhengyang; Sun, Junliang; Cao, Rui |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2015 |
| Journal volume | 15 |
| Journal issue | 5 |
| Pages of publication | 2505 |
| a | 27.3816 ± 0.0007 Å |
| b | 27.3816 ± 0.0007 Å |
| c | 19.3573 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 14513.2 ± 0.7 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 82 |
| Hermann-Mauguin space group symbol | I -4 |
| Hall space group symbol | I -4 |
| Residual factor for all reflections | 0.1113 |
| Residual factor for significantly intense reflections | 0.0541 |
| Weighted residual factors for significantly intense reflections | 0.1173 |
| Weighted residual factors for all reflections included in the refinement | 0.1368 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.987 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 138071 (current) | 2015-06-05 | cif/ Updating files of 4512909 Original log message: Adding full bibliography for 4512909.cif. |
4512909.cif |
| 136227 | 2015-05-13 | cif/ Adding structures of 4512909 via cif-deposit CGI script. |
4512909.cif |
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Users of the data should acknowledge the original authors of the
structural data.