4A6
Summary
| Name: | [(1,2,3,4,5,6-eta)-1-methyl-4-(propan-2-yl)benzene]ruthenium |
| Formula: | C10 H14 Ru |
| Formal charge: | 0 |
| Formula weight: | 235.288 Da |
| Component type: | NON-POLYMER |
| Ambiguous Chemistry Warning: | The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution. |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H8.Ru/c1-8(2)10-6-4-9(3)5-7-10;/h3H2,1-2H3; |
| InChIKey | InChI | 1.03 | UGCPEEMQJJGXOS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [Ru]|1|2|3|4|5|C6=C|1[C]|2(=C|3C|4=[C]|56=C)=C(C)C |
| SMILES | CACTVS | 3.385 | [Ru]|1|2|3|4|5|C6=C|1[C]|2(=C|3C|4=[C]|56=C)=C(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=C12=C3[Ru]1456C2=C4C5(=C63)=C)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=C12=C3[Ru]1456C2=C4C5(=C63)=C)C |
