ZWO
Summary
| Name: | Ru2(DPhF)(CO3)3 |
| Formula: | C16 H11 N2 O9 Ru2 |
| Formal charge: | null |
| Formula weight: | 577.407 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 12,14-diphenyl-2,4,6,8,9,11-hexaoxa-12$l^{4},14-diaza-1$l^{5},5$l^{5}-diruthenatetracyclo[3.3.3.3^{1,5}.0^{1,5}]tetradec-12-ene-3,7,10-trione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H11N2.3CH2O3.2Ru/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;3*2-1(3)4;;/h1-11H;3*(H2,2,3,4);;/q-1;;;;+3;+4/p-6 |
| InChIKey | InChI | 1.06 | YJUNPPYBRZKKCK-UHFFFAOYSA-H |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1O[Ru]2OC(=O)O[Ru](O1)(OC(=O)O2)N(C=Nc3ccccc3)c4ccccc4 |
| SMILES | CACTVS | 3.385 | O=C1O[Ru]2OC(=O)O[Ru](O1)(OC(=O)O2)N(C=Nc3ccccc3)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)[N]2=CN([Ru]345[Ru]2(OC(=O)O3)(OC(=O)O4)OC(=O)O5)c6ccccc6 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)[N]2=CN([Ru]345[Ru]2(OC(=O)O3)(OC(=O)O4)OC(=O)O5)c6ccccc6 |
