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Information card for entry 4319000
Preview
| Coordinates | 4319000.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H51 Ag As3 N3 O2 |
|---|---|
| Calculated formula | C58 H51 Ag As3 N3 O2 |
| SMILES | [Ag]1([O]=NO1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)[As](c1ccccc1)(c1ccccc1)c1ccccc1.N#CC.N#CC |
| Title of publication | Variable Coordination Modes of NO2- in a Series of Ag(I) Complexes Containing Triorganophosphines, -arsines, and -stibines. Syntheses, Spectroscopic Characterization (IR, 1H and 31P NMR, Electrospray Ionization Mass), and Structures of [AgNO2(R3E)x] Adducts (E = P, As, Sb, x = 1-3) |
| Authors of publication | Augusto Cingolani; Effendy; Maura Pellei; Claudio Pettinari; Carlo Santini; Brian W. Skelton; Allan H. White |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2002 |
| Journal volume | 41 |
| Pages of publication | 6633 - 6645 |
| a | 13.391 ± 0.003 Å |
| b | 13.839 ± 0.003 Å |
| c | 14.119 ± 0.003 Å |
| α | 84.994 ± 0.004° |
| β | 89.131 ± 0.004° |
| γ | 77.364 ± 0.004° |
| Cell volume | 2543.4 ± 1 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.131 |
| Residual factor for significantly intense reflections | 0.055 |
| Weighted residual factors for all reflections | 0.062 |
| Weighted residual factors for all reflections included in the refinement | 0.051 |
| Goodness-of-fit parameter for all reflections | 0.975 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.114 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4319000.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4319000.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4319000.cif |
| 15728 | 2011-03-17 | ../uploads/cif-deposit/cod/cif Adding structures of 4319000 via cif-deposit CGI script. |
4319000.cif |
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