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Information card for entry 7019630
Preview
| Coordinates | 7019630.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H66 Ag2 Cl8 N4 O10 P4 |
|---|---|
| Calculated formula | C60 H66 Ag2 Cl8 N4 O10 P4 |
| SMILES | C1N2CC[N+](=C2)C[P](c2ccccc2)(c2ccccc2)[Ag]23[Cl][Ag]([P]1(c1ccccc1)c1ccccc1)([P](CN1CC[N+](C[P]2(c2ccccc2)c2ccccc2)=C1)(c1ccccc1)c1ccccc1)[Cl]3.[O-]Cl(=O)(=O)=O.O.C(Cl)Cl.[O-]Cl(=O)(=O)=O.O.C(Cl)Cl |
| Title of publication | Formation of N-heterocyclic diphosphine ligands from Ag(i)-assisted condensation reactions between bdppeda and formaldehyde and their binuclear silver(i) complexes. |
| Authors of publication | Sun, Sha; Ren, Zhi-Gang; Yang, Ju-Hua; He, Run-Tian; Wang, Fan; Wu, Xin-Yi; Gong, Wei-Jie; Li, Hong-Xi; Lang, Jian-Ping |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 27 |
| Pages of publication | 8447 - 8454 |
| a | 13.601 ± 0.003 Å |
| b | 14.615 ± 0.003 Å |
| c | 17.145 ± 0.003 Å |
| α | 90° |
| β | 90.03 ± 0.03° |
| γ | 90° |
| Cell volume | 3408.1 ± 1.2 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0857 |
| Residual factor for significantly intense reflections | 0.0745 |
| Weighted residual factors for significantly intense reflections | 0.1512 |
| Weighted residual factors for all reflections included in the refinement | 0.1569 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.218 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179900 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/96. |
7019630.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7019630.cif |
| 62928 | 2012-07-09 | cif/ Adding structures of 7019629, 7019630, 7019631 via cif-deposit CGI script. |
7019630.cif |
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