bis(chloranyl)-[[5-[4-(3-methylimidazol-3-ium-1-yl)butoxy]-2-propan-2-yloxy-phenyl]methylidene]ruthenium; tricyclohexylphosphane; hexafluorophosphate

Systemtic Name: bis(chloranyl)-[[5-[4-(3-methylimidazol-3-ium-1-yl)butoxy]-2-propan-2-yloxy-phenyl]methylidene]ruthenium; tricyclohexylphosphane; hexafluorophosphate Openeye Name: dichloro-[[2-isopropoxy-5-[4-(3-methylimidazol-3-ium-1-yl)butoxy]phenyl]methylene]ruthenium; tricyclohexylphosphane; hexafluorophosphate CAS Name: dichloro-[[5-[4-(3-methyl-1-imidazol-3-iumyl)butoxy]-2-propan-2-yloxyphenyl]methylidene]ruthenium; tricyclohexylphosphine; hexafluorophosphate IUPAC Name: dichloro-[[5-[4-(3-methylimidazol-3-ium-1-yl)butoxy]-2-propan-2-yloxyphenyl]methylidene]ruthenium; tricyclohexylphosphane; hexafluorophosphate Traditional Name: dichloro-[2-isopropoxy-5-[4-(3-methylimidazol-3-ium-1-yl)butoxy]benzylidene]ruthenium; tricyclohexylphosphine; hexafluorophosphate Formula: C36H58Cl2F6N2O2P2Ru MolecularWeight: 898.771861

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)OCCCCN2C=C[N+](=C2)C)C=[Ru](Cl)Cl.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)OCCCCN2C=C[N+](=C2)C)C=[Ru](Cl)Cl.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C18H25N2O2.C18H33P.2ClH.F6P.Ru/c1-15(2)22-18-8-7-17(13-16(18)3)21-12-6-5-9-20-11-10-19(4)14-20;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;1-7(2,3,4,5)6;/h3,7-8,10-11,13-15H,5-6,9,12H2,1-2,4H3;16-18H,1-15H2;2*1H;;/q+1;;;;-1;+2/p-2