Geometry & MOs

Info

ID:	268076
PubChem CID:	103597709
Reduced:	N2O3C21H22 (1)
Stoich.:	A2B3C21D22 (1)
Weight, g/mol:	286.113984
ΔH_f, kcal/mol:	-38.8
Dipole, Da:	5.15
IP(EA), eV:	-8.87(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-ethyl-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(C)NC(=O)C=CC2=CC=C(C=C2)OCC#N

DOS

IR

Vibrations