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Information card for entry 4337964
Preview
| Coordinates | 4337964.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H18 Cl7 Ga2 N3 P2 Si2 |
|---|---|
| Calculated formula | C6 H18 Cl7 Ga2 N3 P2 Si2 |
| SMILES | [P+]1(N([Si](C)(C)C)P(N1[Si](C)(C)C)Cl)(N1[Ga]2(Cl)(Cl)[Cl][Ga]12(Cl)Cl)Cl |
| Title of publication | Azidophosphenium Cations: Versatile Reagents in Inorganic Synthesis. |
| Authors of publication | Hering, Christian; Hertrich, Maximilian; Schulz, Axel; Villinger, Alexander |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 7 |
| Pages of publication | 3880 |
| a | 16.1569 ± 0.0008 Å |
| b | 16.6106 ± 0.0008 Å |
| c | 17.3001 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4642.9 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0664 |
| Residual factor for significantly intense reflections | 0.0328 |
| Weighted residual factors for significantly intense reflections | 0.0612 |
| Weighted residual factors for all reflections included in the refinement | 0.0671 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179482 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/79. |
4337964.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' |
4337964.cif |
| 109930 | 2014-04-17 | cif/ Updating files of 4337958, 4337959, 4337960, 4337961, 4337962, 4337963, 4337964, 4337965, 4337966, 4337967 Original log message: Adding full bibliography for 4337958--4337967.cif. |
4337964.cif |
| 108508 | 2014-04-02 | cif/ Adding structures of 4337958, 4337959, 4337960, 4337961, 4337962, 4337963, 4337964, 4337965, 4337966, 4337967 via cif-deposit CGI script. |
4337964.cif |
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Users of the data should acknowledge the original authors of the
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