Geometry & MOs

Info

ID:	340243
PubChem CID:	127262252
Reduced:	NOSC7H7 (2)
Stoich.:	ABCD7E7 (2)
Weight, g/mol:	245.009969
ΔH_f, kcal/mol:	-3.5
Dipole, Da:	5.49
IP(EA), eV:	-9.21(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)propan-2-yl carbamodithioate

Drug info:

PubChemData

Smile

CSC(=N)N(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations