Geometry & MOs

Info

ID:	5236
PubChem CID:	12808
Reduced:	ClNS2C8H8 (1)
Stoich.:	ABC2D8E8 (1)
Weight, g/mol:	216.978669
ΔH_f, kcal/mol:	38.23
Dipole, Da:	2.72
IP(EA), eV:	-9.04(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-1-methylsulfanylmethanimidothioic acid

Drug info:

PubChemData

Smile

CSC(=NC1=CC=C(C=C1)Cl)S

DOS

IR

Vibrations