carbon monoxide; chloranylruthenium(1+); ethenylbenzene; tricyclohexylphosphane

Systemtic Name: carbon monoxide; chloranylruthenium(1+); ethenylbenzene; tricyclohexylphosphane Openeye Name: carbon monoxide; chlororuthenium(1+); tricyclohexylphosphane; vinylbenzene CAS Name: carbon monoxide; chlororuthenium(1+); ethenylbenzene; tricyclohexylphosphine IUPAC Name: carbon monoxide; chlororuthenium(1+); ethenylbenzene; tricyclohexylphosphane Traditional Name: carbon monoxide; chlororuthenium(1+); tricyclohexylphosphine; vinylbenzene Formula: C45H73ClOP2Ru MolecularWeight: 828.531042

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]=CC1=CC=CC=C1.[C-]#[O+].C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.Cl[Ru+]

Isomeric SMILES

[CH-]=CC1=CC=CC=C1.[C-]#[O+].C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.Cl[Ru+]

InChI

InChI=1S/2C18H33P.C8H7.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;1-2-8-6-4-3-5-7-8;1-2;;/h2*16-18H,1-15H2;1-7H;;1H;/q;;-1;;;+2/p-1