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Information card for entry 7019175
Preview
| Coordinates | 7019175.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C70 H88 Cl2 O8 P2 Pt |
|---|---|
| Calculated formula | C68 H80 Cl2 O6 P2 Pt |
| Title of publication | A bisphosphonite calix[5]arene ligand that stabilizes η(6) arene coordination to palladium. |
| Authors of publication | Rios, Beatriz E.; Sood, Paul; Klichko, Yaroslav; Koutha, Mohan; Powell, Douglas; Lattman, Michael |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 22 |
| Pages of publication | 6677 - 6682 |
| a | 12.4596 ± 0.0014 Å |
| b | 15.9029 ± 0.0018 Å |
| c | 17.1665 ± 0.0018 Å |
| α | 97.391 ± 0.002° |
| β | 98.535 ± 0.002° |
| γ | 97.493 ± 0.003° |
| Cell volume | 3296.8 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0461 |
| Residual factor for significantly intense reflections | 0.0387 |
| Weighted residual factors for significantly intense reflections | 0.0926 |
| Weighted residual factors for all reflections included in the refinement | 0.0961 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179895 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/91. |
7019175.cif |
| 132410 | 2015-02-25 | cod/ (robertas@burundukas) Replaced zero-length value of the tag '_chemical_name_systematic' with '?'. codsql 'select file, chemname from data \ where length(chemname) = 0' -NB \ | perl -ne 'print $1."\n" if /\b(\d{7})\s*$/' \ | codid2file \ | xargs perl -0777 -i -pe 's/\b_chemical_name_systematic \K \s*? ( \n ; \s*? \n ; | '\'' \s* '\'' \s*? ) (?=\n) /" " x8 . "?"/ixmse' |
7019175.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7019175.cif |
| 60458 | 2012-06-14 | cif/ Adding structures of 7019175, 7019176, 7019177 via cif-deposit CGI script. |
7019175.cif |
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