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Information card for entry 4309310
Preview
| Coordinates | 4309310.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H114 Al10 N4 |
|---|---|
| Calculated formula | C48 H114 Al10 N4 |
| SMILES | [AlH]12[C]34([AlH]5[C]67([AlH]8[C]9%10([AlH]([C]1%11([AlH]3[C]58([AlH]%10%11)CC(C)(C)C)CC(C)(C)C)[C]12([AlH]69[AlH]471)CC(C)(C)C)CC(C)(C)C)CC(C)(C)C)CC(C)(C)C.[AlH2]([N](C)(C)C)[N](C)(C)C.[AlH2]([N](C)(C)C)[N](C)(C)C |
| Title of publication | Aluminum Hydride Cations Stabilized by Weakly Coordinating Carbaalanates |
| Authors of publication | Andreas Stasch; Herbert W. Roesky; Mathias Noltemeyer; Hans-Georg Schmidt |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 5854 - 5857 |
| a | 13.013 ± 0.003 Å |
| b | 15.676 ± 0.004 Å |
| c | 16.321 ± 0.003 Å |
| α | 90° |
| β | 94.375 ± 0.017° |
| γ | 90° |
| Cell volume | 3319.6 ± 1.3 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1412 |
| Residual factor for significantly intense reflections | 0.0846 |
| Weighted residual factors for significantly intense reflections | 0.2008 |
| Weighted residual factors for all reflections included in the refinement | 0.2182 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179131 (current) | 2016-03-23 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/93. |
4309310.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4309310.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4309310.cif |
| 1526 | 2010-09-26 | cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming). |
4309310.cif |
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Users of the data should acknowledge the original authors of the
structural data.