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Information card for entry 4343192
Preview
| Coordinates | 4343192.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H11 Cl Hg N4 O7 |
|---|---|
| Calculated formula | C10 H11 Cl Hg N4 O7 |
| Title of publication | Regioselectivity of the C-metalation of 6-furylpurine: importance of directing effects. |
| Authors of publication | Sinha, Indranil; Hepp, Alexander; Schirmer, Birgitta; Kösters, Jutta; Neugebauer, Johannes; Müller, Jens |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 9 |
| Pages of publication | 4183 - 4185 |
| a | 7.9691 ± 0.0006 Å |
| b | 8.4518 ± 0.0006 Å |
| c | 11.3366 ± 0.0008 Å |
| α | 110.039 ± 0.002° |
| β | 96.654 ± 0.002° |
| γ | 100.234 ± 0.002° |
| Cell volume | 692.9 ± 0.09 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 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 | 0.0272 |
| Residual factor for significantly intense reflections | 0.0265 |
| Weighted residual factors for significantly intense reflections | 0.07 |
| Weighted residual factors for all reflections included in the refinement | 0.0705 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 137937 (current) | 2015-06-04 | cif/ Adding structures of 4343192 via cif-deposit CGI script. |
4343192.cif |
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Users of the data should acknowledge the original authors of the
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