Geometry & MOs

Info

ID:	22764
PubChem CID:	598622
Reduced:	OPS3C13H13 (1)
Stoich.:	ABC3D13E13 (1)
Weight, g/mol:	311.986616
ΔH_f, kcal/mol:	-49.75
Dipole, Da:	6.04
IP(EA), eV:	-8.39(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-methylsulfanylphenyl)-sulfanylphosphinothioyl]phenol

Drug info:

PubChemData

Smile

CSC1=CC=CC=C1P(=S)(C2=CC=C(C=C2)O)S

DOS

IR

Vibrations