benzene; bis(chloranyl)alumanylium; carbanide; ruthenium(2+); triphenylphosphane

Systemtic Name: benzene; bis(chloranyl)alumanylium; carbanide; ruthenium(2+); triphenylphosphane Openeye Name: benzene; carbanide; dichloroalumanylium; ruthenium(2+); triphenylphosphane CAS Name: benzene; carbanide; dichloroalumanylium; ruthenium(2+); triphenylphosphine IUPAC Name: benzene; carbanide; dichloroalumanylium; ruthenium(2+); triphenylphosphane Traditional Name: benzene; carbanide; dichloroalumanylium; ruthenium(2+); triphenylphosphine Formula: C45H45AlCl2P2Ru MolecularWeight: 846.74386

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].[CH3-].C1=CC=CC=C1.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.[Al+](Cl)Cl.[Ru+2]

Isomeric SMILES

[CH3-].[CH3-].[CH3-].C1=CC=CC=C1.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.[Al+](Cl)Cl.[Ru+2]

InChI

InChI=1S/2C18H15P.C6H6.3CH3.Al.2ClH.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-5-3-1;;;;;;;/h2*1-15H;1-6H;3*1H3;;2*1H;/q;;;3*-1;+3;;;+2/p-2