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Information card for entry 4078690
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| Coordinates | 4078690.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | jonaw27 |
|---|---|
| Chemical name | Pt(dippe)(k2-O2CC6H4) |
| Formula | C31 H51 O2 P2 Pt |
| Calculated formula | C31 H51 O2 P2 Pt |
| Title of publication | Carbon‒Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond |
| Authors of publication | Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D. |
| Journal of publication | Organometallics |
| Year of publication | 2012 |
| Journal volume | 31 |
| Journal issue | 14 |
| Pages of publication | 5018 |
| a | 10.5526 ± 0.0006 Å |
| b | 10.5591 ± 0.0006 Å |
| c | 15.7804 ± 0.0009 Å |
| α | 82.093 ± 0.001° |
| β | 70.687 ± 0.001° |
| γ | 71.712 ± 0.001° |
| Cell volume | 1574.46 ± 0.16 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0529 |
| Residual factor for significantly intense reflections | 0.0342 |
| Weighted residual factors for significantly intense reflections | 0.0666 |
| Weighted residual factors for all reflections included in the refinement | 0.0721 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178675 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/86. |
4078690.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4078690.cif |
| 66366 | 2012-09-09 | cif/ Adding structures of 4078686, 4078687, 4078688, 4078689, 4078690, 4078691 via cif-deposit CGI script. |
4078690.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.