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Information card for entry 4345758
Preview
| Coordinates | 4345758.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C120 H100 Ag2 Cl10 N2 O8 P6 Pt |
|---|---|
| Calculated formula | C116 H92 Ag2 Cl2 N2 O8 P6 Pt |
| SMILES | C1[P@]2([Pt]3([C](#Cc4ccc(n5c6ccccc6c6ccccc56)cc4)[Ag]([P]1(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)[P@](C[P](c1ccccc1)(c1ccccc1)[Ag]([P](c1ccccc1)(c1ccccc1)c1ccccc1)[C]3#Cc1ccc(n3c4ccccc4c4ccccc34)cc1)(CC2)c1ccccc1)c1ccccc1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.C1[P@@]2([Pt]3([C](#Cc4ccc(n5c6ccccc6c6ccccc56)cc4)[Ag]([P]1(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)[P@@](C[P](c1ccccc1)(c1ccccc1)[Ag]([P](c1ccccc1)(c1ccccc1)c1ccccc1)[C]3#Cc1ccc(n3c4ccccc4c4ccccc34)cc1)(CC2)c1ccccc1)c1ccccc1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O |
| Title of publication | Photophysical and Electroluminescent Properties of PtAg2 Acetylide Complexes Supported with meso- and rac-Tetraphosphine. |
| Authors of publication | Shu, Hui-Xing; Wang, Jin-Yun; Zhang, Qian-Chong; Chen, Zhong-Ning |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2017 |
| Journal volume | 56 |
| Journal issue | 16 |
| Pages of publication | 9461 - 9473 |
| a | 19.8428 ± 0.0011 Å |
| b | 23.6605 ± 0.001 Å |
| c | 26.0484 ± 0.0011 Å |
| α | 90° |
| β | 95.874 ± 0.004° |
| γ | 90° |
| Cell volume | 12165.3 ± 1 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0425 |
| Residual factor for significantly intense reflections | 0.0376 |
| Weighted residual factors for significantly intense reflections | 0.098 |
| Weighted residual factors for all reflections included in the refinement | 0.1014 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 200655 (current) | 2017-09-12 | cif/ Updating files of 4345758, 4345759 Original log message: Adding full bibliography for 4345758--4345759.cif. |
4345758.cif |
| 195786 | 2017-04-27 | cif/ Adding structures of 4345758, 4345759 via cif-deposit CGI script. |
4345758.cif |
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