Geometry & MOs

Info

ID:	27098
PubChem CID:	814306
Reduced:	SO2N3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	335.110376
ΔH_f, kcal/mol:	-38.39
Dipole, Da:	0.55
IP(EA), eV:	-8.89(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-N-ethyl-4-fluorobenzamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=NC(=C(S1)C)C)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations