Geometry & MOs

Info

ID:	228182
PubChem CID:	87563608
Reduced:	NO3H15C18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	365.06009
ΔH_f, kcal/mol:	-47.22
Dipole, Da:	1.37
IP(EA), eV:	-8.84(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-carbamoylphenyl)-sulfanylcarbamoyl]-2-methylbenzamide;hydrochloride

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)O)OC2=NC3=C(C=C2)C=C(C=C3)CC=O

DOS

IR

Vibrations