Geometry & MOs

Info

ID:	58037
PubChem CID:	24423654
Reduced:	ClO2S2N3H18C20 (1)
Stoich.:	AB2C2D3E18F20 (1)
Weight, g/mol:	468.988853
ΔH_f, kcal/mol:	-4.01
Dipole, Da:	7.28
IP(EA), eV:	-8.8(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-fluorophenyl)-3-[3-[(2-chlorophenyl)sulfamoyl]phenyl]thiourea

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=S)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3Cl

DOS

IR

Vibrations