Geometry & MOs

Info

ID:	388396
PubChem CID:	134989042
Reduced:	NOC15H25 (1)
Stoich.:	ABC15D25 (1)
Weight, g/mol:	220.94689
ΔH_f, kcal/mol:	-94.54
Dipole, Da:	3.57
IP(EA), eV:	-9.75(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-amino 3,4-dichlorobenzenecarbothioate

Drug info:

PubChemData

Smile

CCNC(=O)CCC12CC3CC(C1)CC(C3)C2

DOS

IR

Vibrations