tert-butyl-(2-methanidylphenyl)-(2-methylphenyl)phosphanium; ethane-1,1-diol; palladium

Systemtic Name: tert-butyl-(2-methanidylphenyl)-(2-methylphenyl)phosphanium; ethane-1,1-diol; palladium Openeye Name: tert-butyl-(2-methanidylphenyl)-(o-tolyl)phosphonium; ethane-1,1-diol; palladium CAS Name: tert-butyl-(2-methanidylphenyl)-(2-methylphenyl)phosphonium; ethane-1,1-diol; palladium IUPAC Name: tert-butyl-(2-methanidylphenyl)-(2-methylphenyl)phosphanium; ethane-1,1-diol; palladium Traditional Name: tert-butyl-(2-methanidylphenyl)-(o-tolyl)phosphonium; ethane-1,1-diol; palladium Formula: C40H58O4P2Pd2 MolecularWeight: 877.673642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[PH+](C2=CC=CC=C2[CH2-])C(C)(C)C.CC1=CC=CC=C1[PH+](C2=CC=CC=C2[CH2-])C(C)(C)C.CC(O)O.CC(O)O.[Pd].[Pd]

Isomeric SMILES

CC1=CC=CC=C1[PH+](C2=CC=CC=C2[CH2-])C(C)(C)C.CC1=CC=CC=C1[PH+](C2=CC=CC=C2[CH2-])C(C)(C)C.CC(O)O.CC(O)O.[Pd].[Pd]

InChI

InChI=1S/2C18H22P.2C2H6O2.2Pd/c2*1-14-10-6-8-12-16(14)19(18(3,4)5)17-13-9-7-11-15(17)2;2*1-2(3)4;;/h2*6-13H,1H2,2-5H3;2*2-4H,1H3;;/q2*-1;;;;/p+2