Geometry & MOs

Info

ID:	338824
PubChem CID:	127259835
Reduced:	OS2H12C14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	338.010508
ΔH_f, kcal/mol:	29.81
Dipole, Da:	2.37
IP(EA), eV:	-8.85(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxyphenyl)sulfonylmethyl benzenecarbodithioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=S)SCC2=CC=C(C=C2)O

DOS

IR

Vibrations