RBU
Summary
| Name: | RUTHEMIUM BIS(2,2'-BIPYRIDINE)-2-IMIDAZOLE |
| Formula: | C23 H20 N6 Ru |
| Formal charge: | null |
| Formula weight: | 481.515 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 8-(1~{H}-imidazol-3-yl)-8,8'-spirobi[7$l^{4},9$l^{4}-diaza-8$l^{5}-ruthenatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene] |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/2C10H8N2.C3H4N2.Ru/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-5-3-4-1;/h2*1-8H;1-3H,(H,4,5); |
| InChIKey | InChI | 1.06 | LVAGRRXZENULKW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [Ru].[nH]1ccnc1.c2ccc(nc2)c3ccccn3.c4ccc(nc4)c5ccccn5 |
| SMILES | CACTVS | 3.385 | [Ru].[nH]1ccnc1.c2ccc(nc2)c3ccccn3.c4ccc(nc4)c5ccccn5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C1=CC2=[N](C=C1)[Ru]3([N]4=C2C=CC=C4)([N]5=C(C=CC=C5)C6=[N]3C=CC=C6)[N]7=CNC=C7 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | C1=CC2=[N](C=C1)[Ru]3([N]4=C2C=CC=C4)([N]5=C(C=CC=C5)C6=[N]3C=CC=C6)[N]7=CNC=C7 |
