but-3-yn-2-ol; palladium(2+); triphenylphosphane

Systemtic Name: but-3-yn-2-ol; palladium(2+); triphenylphosphane Openeye Name: but-3-yn-2-ol; palladium(2+); triphenylphosphane CAS Name: 3-butyn-2-ol; palladium(2+); triphenylphosphine IUPAC Name: but-3-yn-2-ol; palladium(2+); triphenylphosphane Traditional Name: but-3-yn-2-ol; palladium(2+); triphenylphosphine Formula: C76H66OP4Pd+2 MolecularWeight: 1225.651684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd+2]

Isomeric SMILES

CC(C#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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd+2]

InChI

InChI=1S/4C18H15P.C4H6O.Pd/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-4(2)5;/h4*1-15H;1,4-5H,2H3;/q;;;;;+2