Geometry & MOs

Info

ID:	341655
PubChem CID:	127264348
Reduced:	AuPH25C34 (1)
Stoich.:	ABC25D34 (1)
Weight, g/mol:	547.110137
ΔH_f, kcal/mol:	299.0
Dipole, Da:	2.28
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.880516
Charge, e:	1

Chem-info

IUPAC name:

gold(1+);2-methylpropanoate;triphenylphosphanium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC2=C3C(=C1)C=CC4=[C-]C=CC(=C43)C=C2.[Au+]

DOS

IR

Vibrations