Geometry & MOs

Info

ID:	228211
PubChem CID:	87563672
Reduced:	SO2Cl3N3H12C15 (1)
Stoich.:	AB2C3D3E12F15 (1)
Weight, g/mol:	418.966496
ΔH_f, kcal/mol:	-72.69
Dipole, Da:	5.4
IP(EA), eV:	-9.41(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-carbamoylphenyl)-sulfanylcarbamoyl]-3,4-dichlorobenzamide;hydrochloride

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N)NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)Cl.Cl

DOS

IR

Vibrations