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Information card for entry 2019162
Preview
| Coordinates | 2019162.cif |
|---|---|
| Structure factors | 2019162.hkl |
| Original IUCr paper | HTML |
| Chemical name | Hydrido[tris(3-<i>tert</i>-butyl-5-methyl-1<i>H</i>-pyrazol-1-yl-κ<i>N</i>^2^)hydroborato]gallium(III) tetrachloridogallium(III), |
|---|---|
| Formula | C24 H41 B Cl4 Ga2 N6 |
| Calculated formula | C24 H41 B Cl4 Ga2 N6 |
| SMILES | [GaH]12[n]3n([BH](n4c(cc([n]14)C(C)(C)C)C)n1c(cc([n]21)C(C)(C)C)C)c(cc3C(C)(C)C)C.[Ga](Cl)(Cl)(Cl)[Cl-] |
| Title of publication | Gallium hydride and monovalent indium compounds that feature tris(pyrazolyl)hydroborate ligands |
| Authors of publication | Yurkerwich, Kevin; Rong, Yi; Parkin, Gerard |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 9 |
| Pages of publication | 963 - 967 |
| a | 9.517 ± 0.0015 Å |
| b | 17.753 ± 0.003 Å |
| c | 19.763 ± 0.003 Å |
| α | 90° |
| β | 93.952 ± 0.003° |
| γ | 90° |
| Cell volume | 3331.1 ± 0.9 Å3 |
| Cell temperature | 125 ± 2 K |
| Ambient diffraction temperature | 125 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.159 |
| Residual factor for significantly intense reflections | 0.0625 |
| Weighted residual factors for significantly intense reflections | 0.0911 |
| Weighted residual factors for all reflections included in the refinement | 0.1162 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180860 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/91. |
2019162.cif 2019162.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019162.cif 2019162.hkl |
| 89416 | 2013-10-25 | cif/ (saulius@koala.ibt.lt) Adding links pointing to FOBS data to the recently deposited structures from IUCr. |
2019162.cif 2019162.hkl |
| 89414 | 2013-10-24 | cod/ (saulius@koala.ibt.lt) Adding FOBS data for the recently deposited IUCr structures. |
2019162.cif 2019162.hkl |
| 88743 | 2013-10-02 | cif/ Adding structures of 2019160, 2019161, 2019162 via cif-deposit CGI script. |
2019162.cif |
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Users of the data should acknowledge the original authors of the
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