carbon monoxide; chloranylruthenium(1+); 4-methyl-2-(methyliminomethyl)cyclohexa-2,4-dien-1-one; triphenylphosphane

Systemtic Name: carbon monoxide; chloranylruthenium(1+); 4-methyl-2-(methyliminomethyl)cyclohexa-2,4-dien-1-one; triphenylphosphane Openeye Name: carbon monoxide; chlororuthenium(1+); 4-methyl-2-(methyliminomethyl)cyclohexa-2,4-dien-1-one; triphenylphosphane CAS Name: carbon monoxide; chlororuthenium(1+); 4-methyl-2-(methyliminomethyl)-1-cyclohexa-2,4-dienone; triphenylphosphine IUPAC Name: carbon monoxide; chlororuthenium(1+); 4-methyl-2-(methyliminomethyl)cyclohexa-2,4-dien-1-one; triphenylphosphane Traditional Name: carbon monoxide; chlororuthenium(1+); 4-methyl-2-(methyliminomethyl)cyclohexa-2,4-dien-1-one; triphenylphosphine Formula: C46H40ClNO2P2Ru MolecularWeight: 837.285822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C18H15P.C9H10NO.CO.ClH.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-7-3-4-9(11)8(5-7)6-10-2;1-2;;/h2*1-15H;3-6H,1-2H3;;1H;/q;;-1;;;+2/p-1