ZQ2
Summary
| Name: | (mu-acetato-kappaO:kappaO')-(mu-{N-[(phenylimino-kappaN)methyl]benzenaminido-kappaN})diruthenium(Ru-Ru) |
| Synonyms: | 3-methyl-6,8-diphenyl-2,4-dioxa-6,8-diaza-1$l^{3},5$l^{3}-diruthenabicyclo[3.3.0]octane |
| Formula: | C15 H14 N2 O2 Ru2 |
| Formal charge: | null |
| Formula weight: | 456.424 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (mu-acetato-kappaO:kappaO')-(mu-{N-[(phenylimino-kappaN)methyl]benzenaminido-kappaN})diruthenium(Ru-Ru) |
| OpenEye OEToolkits | 3.1.0.0 | 3-methyl-6,8-diphenyl-2$l^{3},4-dioxa-6,8$l^{4}-diaza-1$l^{3},5$l^{3}-diruthenabicyclo[3.3.0]octa-2,7-diene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC=1O[Ru]2N(C=N([Ru]2O=1)c1ccccc1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H11N2.C2H4O2.2Ru/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;1-2(3)4;;/h1-11H;1H3,(H,3,4);;/q-1;;;+2/p-1 |
| InChIKey | InChI | 1.06 | GQQXJQJNEVDDNS-UHFFFAOYSA-M |
| SMILES_CANONICAL | CACTVS | 3.385 | [Ru].CC(=O)O[Ru]N(C=Nc1ccccc1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | [Ru].CC(=O)O[Ru]N(C=Nc1ccccc1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC1=O[Ru]2[N](=CN([Ru]2O1)c3ccccc3)c4ccccc4 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1=O[Ru]2[N](=CN([Ru]2O1)c3ccccc3)c4ccccc4 |
