Geometry & MOs

Info

ID:	341668
PubChem CID:	127264361
Reduced:	AuPSC17H23 (1)
Stoich.:	ABCD17E23 (1)
Weight, g/mol:	425.076729
ΔH_f, kcal/mol:	88.9
Dipole, Da:	3.01
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.750000
Charge, e:	1

Chem-info

IUPAC name:

dimethyl(phenyl)phosphanium;gold(1+);2-methylpropane-2-thiolate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations