Geometry & MOs

Info

ID:	227910
PubChem CID:	87562963
Reduced:	ClSO2N3C16H16 (1)
Stoich.:	ABC2D3E16F16 (1)
Weight, g/mol:	329.083413
ΔH_f, kcal/mol:	-59.77
Dipole, Da:	6.03
IP(EA), eV:	-8.6(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-carbamoylphenyl)-sulfanylcarbamoyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N.Cl

DOS

IR

Vibrations