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Information card for entry 4341234
Preview
| Coordinates | 4341234.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H52 B Cl Co F4 N10 O8 Re |
|---|---|
| Calculated formula | C38 H52 B Cl Co F4 N10 O8 Re |
| Title of publication | Models for B12-Conjugated Radiopharmaceuticals. Cobaloxime Binding to New fac-[Re(CO)3(Me2Bipyridine)(amidine)]BF4 Complexes Having an Exposed Pyridyl Nitrogen. |
| Authors of publication | Lewis, Nerissa A.; Marzilli, Patricia A.; Fronczek, Frank R.; Marzilli, Luigi G. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 20 |
| Pages of publication | 11096 - 11107 |
| a | 10.997 ± 0.003 Å |
| b | 14.686 ± 0.003 Å |
| c | 16.078 ± 0.004 Å |
| α | 105.787 ± 0.015° |
| β | 105.748 ± 0.015° |
| γ | 102.678 ± 0.014° |
| Cell volume | 2281.1 ± 1 Å3 |
| Cell temperature | 90 ± 0.5 K |
| Ambient diffraction temperature | 90 ± 0.5 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0711 |
| Residual factor for significantly intense reflections | 0.0497 |
| Weighted residual factors for significantly intense reflections | 0.1147 |
| Weighted residual factors for all reflections included in the refinement | 0.1219 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179515 (current) | 2016-03-23 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/12. |
4341234.cif |
| 126927 | 2014-11-12 | cif/ Updating files of 4341231, 4341232, 4341233, 4341234 Original log message: Adding full bibliography for 4341231--4341234.cif. |
4341234.cif |
| 124999 | 2014-10-07 | cif/ Adding structures of 4341231, 4341232, 4341233, 4341234 via cif-deposit CGI script. |
4341234.cif |
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Users of the data should acknowledge the original authors of the
structural data.