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Information card for entry 4084904
Preview
| Coordinates | 4084904.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C24 H60 P4 Pt |
|---|---|
| Calculated formula | C24 H60 P4 Pt |
| SMILES | [P](CC)(CC)(CC)[Pt]([P](CC)(CC)CC)([P](CC)(CC)CC)[P](CC)(CC)CC |
| Title of publication | Insertion Reactions into the Boron–Boron Bonds of Barrelene-Type 1,2-Diaminodiboranes(4) |
| Authors of publication | Pospiech, Steffen; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias |
| Journal of publication | Organometallics |
| Year of publication | 2014 |
| Journal volume | 33 |
| Journal issue | 23 |
| Pages of publication | 6967 |
| a | 10.0444 ± 0.0005 Å |
| b | 19.2141 ± 0.0008 Å |
| c | 15.9729 ± 0.0007 Å |
| α | 90° |
| β | 99.758 ± 0.004° |
| γ | 90° |
| Cell volume | 3038.1 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0301 |
| Residual factor for significantly intense reflections | 0.0296 |
| Weighted residual factors for significantly intense reflections | 0.0725 |
| Weighted residual factors for all reflections included in the refinement | 0.0729 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301831 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/08/ Each referenced PubChem compound corresponds to the full crystal structure. |
4084904.cif |
| 178738 | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/49. |
4084904.cif |
| 132087 | 2015-02-19 | cif/ (antanas@koala.ibt.lt) Replacing '_chemical_name_systematic' tag values consisting ';' with '?'. |
4084904.cif |
| 131482 | 2015-02-08 | cif/ Updating files of 4084899, 4084900, 4084901, 4084902, 4084903, 4084904 Original log message: Adding full bibliography for 4084899--4084904.cif. |
4084904.cif |
| 128436 | 2014-12-06 | cif/ Adding structures of 4084899, 4084900, 4084901, 4084902, 4084903, 4084904 via cif-deposit CGI script. |
4084904.cif |
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Users of the data should acknowledge the original authors of the
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