Geometry & MOs

Info

ID:	27103
PubChem CID:	814314
Reduced:	SN3O3C14H17 (1)
Stoich.:	AB3C3D14E17 (1)
Weight, g/mol:	331.135448
ΔH_f, kcal/mol:	-67.79
Dipole, Da:	3.34
IP(EA), eV:	-9.05(-0.72)
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-2-methylbenzamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=NC(=C(S1)C)C)C(=O)C2=CC=CO2

DOS

IR

Vibrations