(2-methanidylphenyl)-bis(2-methylphenyl)phosphane; (Z)-4-oxidanylpent-3-en-2-one; palladium

Systemtic Name: (2-methanidylphenyl)-bis(2-methylphenyl)phosphane; (Z)-4-oxidanylpent-3-en-2-one; palladium Openeye Name: (Z)-4-hydroxypent-3-en-2-one; (2-methanidylphenyl)-bis(o-tolyl)phosphane; palladium CAS Name: (Z)-4-hydroxy-3-penten-2-one; (2-methanidylphenyl)-bis(2-methylphenyl)phosphine; palladium IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; (2-methanidylphenyl)-bis(2-methylphenyl)phosphane; palladium Traditional Name: (Z)-4-hydroxypent-3-en-2-one; (2-methanidylphenyl)-bis(o-tolyl)phosphine; palladium Formula: C52H56O4P2Pd2-2 MolecularWeight: 1019.786162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3[CH2-].CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3[CH2-].CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Pd].[Pd]

Isomeric SMILES

CC1=CC=CC=C1P(C2=CC=CC=C2[CH2-])C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2[CH2-])C3=CC=CC=C3C.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Pd].[Pd]

InChI

InChI=1S/2C21H20P.2C5H8O2.2Pd/c2*1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3;2*1-4(6)3-5(2)7;;/h2*4-15H,1H2,2-3H3;2*3,6H,1-2H3;;/q2*-1;;;;/b;;2*4-3-;;