5LN
Summary
Name: | chloranyl-bis(hydroxymethyl)-bis(oxidanyl)ruthenium |
Synonyms: | Ru(CO)2Cl(OH2)2 |
Formula: | C2 H8 Cl O4 Ru |
Formal charge: | 0 |
Formula weight: | 232.606 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.4 | chloranyl-bis(hydroxymethyl)-bis(oxidanyl)ruthenium |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/2CH3O.ClH.2H2O.Ru/c2*1-2;;;;/h2*2H,1H2;1H;2*1H2;/q;;;;;+3/p-3 |
InChIKey | InChI | 1.03 | KMSYBSCWEKUGEO-UHFFFAOYSA-K |
SMILES_CANONICAL | CACTVS | 3.385 | OC[Ru](O)(O)(Cl)CO |
SMILES | CACTVS | 3.385 | OC[Ru](O)(O)(Cl)CO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C(O)[Ru](CO)(O)(O)Cl |
SMILES | OpenEye OEToolkits | 2.0.4 | C(O)[Ru](CO)(O)(O)Cl |