Geometry & MOs

Info

ID:	58039
PubChem CID:	24423663
Reduced:	Cl2O2S2N3H17C20 (1)
Stoich.:	A2B2C2D3E17F20 (1)
Weight, g/mol:	435.084197
ΔH_f, kcal/mol:	-14.64
Dipole, Da:	6.21
IP(EA), eV:	-8.88(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bicyclo[2.2.1]heptanyl)-3-[3-[(2-chlorophenyl)sulfamoyl]phenyl]thiourea

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3Cl)Cl

DOS

IR

Vibrations