carbon monoxide; (6-methylpyridin-2-yl)azanide; 2-phenylethenylbenzene; ruthenium(1+); triphenylphosphane; triphenylphosphanium

Systemtic Name: carbon monoxide; (6-methylpyridin-2-yl)azanide; 2-phenylethenylbenzene; ruthenium(1+); triphenylphosphane; triphenylphosphanium Openeye Name: carbon monoxide; (6-methyl-2-pyridyl)azanide; 2-phenylvinylbenzene; ruthenium(1+); triphenylphosphane; triphenylphosphonium CAS Name: carbon monoxide; (6-methyl-2-pyridinyl)azanide; 2-phenylethenylbenzene; ruthenium(1+); triphenylphosphine; triphenylphosphonium IUPAC Name: carbon monoxide; (6-methylpyridin-2-yl)azanide; 2-phenylethenylbenzene; ruthenium(1+); triphenylphosphane; triphenylphosphanium Traditional Name: carbon monoxide; (6-methyl-2-pyridyl)azanide; 2-phenylvinylbenzene; ruthenium(1+); triphenylphosphine; triphenylphosphonium Formula: C62H49N2O6P2Ru2+ MolecularWeight: 1182.149782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)[NH-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C=[C-]C2=CC=CC=C2.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ru+].[Ru+]

Isomeric SMILES

CC1=NC(=CC=C1)[NH-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C=[C-]C2=CC=CC=C2.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ru+].[Ru+]

InChI

InChI=1S/2C18H15P.C14H11.C6H7N2.6CO.2Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14;1-5-3-2-4-6(7)8-5;6*1-2;;/h2*1-15H;1-11H;2-4H,1H3,(H-,7,8);;;;;;;;/q;;2*-1;;;;;;;2*+1/p+1