bis(bromanyl)ruthenium; [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenyl-phosphane; propan-2-one

Systemtic Name: bis(bromanyl)ruthenium; [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenyl-phosphane; propan-2-one Openeye Name: acetone; dibromoruthenium; [1-(2-diphenylphosphanyl-1-naphthyl)-2-naphthyl]-diphenyl-phosphane CAS Name: dibromoruthenium; [1-(2-diphenylphosphino-1-naphthalenyl)-2-naphthalenyl]-diphenylphosphine; 2-propanone IUPAC Name: dibromoruthenium; [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane; propan-2-one Traditional Name: acetone; dibromoruthenium; [1-(2-diphenylphosphino-1-naphthyl)-2-naphthyl]-diphenyl-phosphine Formula: C91H70Br4OP4Ru2 MolecularWeight: 1825.179944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.Br[Ru]Br.Br[Ru]Br

Isomeric SMILES

CC(=O)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.Br[Ru]Br.Br[Ru]Br

InChI

InChI=1S/2C44H32P2.C3H6O.4BrH.2Ru/c2*1-5-19-35(20-6-1)45(36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)46(37-23-9-3-10-24-37)38-25-11-4-12-26-38;1-3(2)4;;;;;;/h2*1-32H;1-2H3;4*1H;;/q;;;;;;;2*+2/p-4