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Information card for entry 7026520
Preview
| Coordinates | 7026520.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H68 Cl12 Ga6 N6 O12 |
|---|---|
| Calculated formula | C32 H68 Cl12 Ga6 N6 O12 |
| SMILES | C1C[N]2(C)CC[O]3[Ga]452([O]1[Ga]126([N](CC[O]6[Ga]678([N](CC[O]7[Ga]79%10([N](CC[O]7[Ga]7%11%12([N](CC[O]%11[Ga]%11%133([N](CC[O]5%11)(C)CC[O]7%13)Cl)(C)CC[O]%10%12)Cl)(C)CC[O]69)Cl)(C)CC[O]28)Cl)(C)CC[O]41)Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl |
| Title of publication | Aminoalkoxo-supported heteroleptic hexanuclear gallium(III) wheel as a synthon for group 13 heterometallics: a rare sol-gel precursor for mixed Al-Ga oxide as support for gold catalysts. |
| Authors of publication | Mishra, Shashank; Jeanneau, Erwann; Daniele, Stéphane; Mendez, Violaine |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2010 |
| Journal volume | 39 |
| Journal issue | 32 |
| Pages of publication | 7440 - 7443 |
| a | 13.787 ± 0.0002 Å |
| b | 18.689 ± 0.002 Å |
| c | 11.187 ± 0.002 Å |
| α | 90° |
| β | 105.58 ± 0.02° |
| γ | 90° |
| Cell volume | 2776.6 ± 0.6 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 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 | 0.1145 |
| Residual factor for significantly intense reflections | 0.0583 |
| Weighted residual factors for all reflections | 0.1609 |
| Weighted residual factors for significantly intense reflections | 0.1447 |
| Weighted residual factors for all reflections included in the refinement | 0.1609 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.8052 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179971 (current) | 2016-03-25 | cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/65. |
7026520.cif |
| 93522 | 2014-01-13 | cif/ Adding structures of 7026520, 7026521 via cif-deposit CGI script. |
7026520.cif |
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Users of the data should acknowledge the original authors of the
structural data.