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Information card for entry 4089707
Preview
| Coordinates | 4089707.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H28 Cl4 I3 N5 Pd |
|---|---|
| Calculated formula | C20 H28 Cl4 I3 N5 Pd |
| Title of publication | Chelating Bis-N-heterocyclic Carbene‒Palladium(II) Complexes for Oxidative Arene C‒H Functionalization |
| Authors of publication | Desai, Sai Puneet; Mondal, Moumita; Choudhury, Joyanta |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 12 |
| Pages of publication | 2731 |
| a | 27.9849 ± 0.0015 Å |
| b | 12.9449 ± 0.0007 Å |
| c | 7.9074 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2864.5 ± 0.3 Å3 |
| Cell temperature | 109 ± 2 K |
| Ambient diffraction temperature | 109 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.1023 |
| Residual factor for significantly intense reflections | 0.0733 |
| Weighted residual factors for significantly intense reflections | 0.1534 |
| Weighted residual factors for all reflections included in the refinement | 0.1645 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.131 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243725 (current) | 2019-11-26 | cif/ Adding structures of 4089707, 4089708 via cif-deposit CGI script. |
4089707.cif |
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Users of the data should acknowledge the original authors of the
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