chloranylruthenium(1+); methanal; triphenylphosphane

Systemtic Name: chloranylruthenium(1+); methanal; triphenylphosphane Openeye Name: chlororuthenium(1+); formaldehyde; triphenylphosphane CAS Name: chlororuthenium(1+); formaldehyde; triphenylphosphine IUPAC Name: chlororuthenium(1+); formaldehyde; triphenylphosphane Traditional Name: chlororuthenium(1+); formaldehyde; triphenylphosphine Formula: C55H47ClOP3Ru+ MolecularWeight: 953.405363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]

Isomeric SMILES

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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]

InChI

InChI=1S/3C18H15P.CH2O.ClH.Ru/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;;/h3*1-15H;1H2;1H;/q;;;;;+2/p-1