Geometry & MOs

Info

ID:	27078
PubChem CID:	814273
Reduced:	NSO3H15C17 (1)
Stoich.:	ABC3D15E17 (1)
Weight, g/mol:	345.114713
ΔH_f, kcal/mol:	-49.74
Dipole, Da:	3.83
IP(EA), eV:	-8.98(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-4-methoxy-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations