chloranylcobalt(2+); 2,3-dimethylbut-2-ene-1,4-dione; triphenylphosphanium

Systemtic Name: chloranylcobalt(2+); 2,3-dimethylbut-2-ene-1,4-dione; triphenylphosphanium Openeye Name: chlorocobalt(2+); 2,3-dimethylbut-2-ene-1,4-dione; triphenylphosphonium CAS Name: chlorocobalt(2+); 2,3-dimethyl-2-butene-1,4-dione; triphenylphosphonium IUPAC Name: chlorocobalt(2+); 2,3-dimethylbut-2-ene-1,4-dione; triphenylphosphanium Traditional Name: chlorocobalt(2+); 2,3-dimethylbut-2-ene-1,4-dione; triphenylphosphonium Formula: C42H38ClCoO2P2+2 MolecularWeight: 731.083642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)[C-]=O)[C-]=O.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.Cl[Co+2]

Isomeric SMILES

CC(=C(C)[C-]=O)[C-]=O.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.Cl[Co+2]

InChI

InChI=1S/2C18H15P.C6H6O2.ClH.Co/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5(3-7)6(2)4-8;;/h2*1-15H;1-2H3;1H;/q;;-2;;+3/p+1