Geometry & MOs

Info

ID:	340643
PubChem CID:	127262654
Reduced:	AuPH21C24 (1)
Stoich.:	ABC21D24 (1)
Weight, g/mol:	698.081706
ΔH_f, kcal/mol:	228.5
Dipole, Da:	8.67
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.128272
Charge, e:	2

Chem-info

IUPAC name:

gold(1+);methyl(diphenyl)phosphanium;perchlorate

Drug info:

PubChemData

Smile

C1=CC=[C-]C=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Au+]

DOS

IR

Vibrations