benzene; chloranylruthenium(1+); methanal; tricyclohexylphosphane

Systemtic Name: benzene; chloranylruthenium(1+); methanal; tricyclohexylphosphane Openeye Name: benzene; chlororuthenium(1+); formaldehyde; tricyclohexylphosphane CAS Name: benzene; chlororuthenium(1+); formaldehyde; tricyclohexylphosphine IUPAC Name: benzene; chlororuthenium(1+); formaldehyde; tricyclohexylphosphane Traditional Name: benzene; chlororuthenium(1+); formaldehyde; tricyclohexylphosphine Formula: C43H73ClOP2Ru MolecularWeight: 804.509642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C18H33P.C6H5.CH2O.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;1-2-4-6-5-3-1;1-2;;/h2*16-18H,1-15H2;1-5H;1H2;1H;/q;;-1;;;+2/p-1