Geometry & MOs

Info

ID:	268232
PubChem CID:	103598497
Reduced:	OSN2C15H16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	310.088832
ΔH_f, kcal/mol:	9.8
Dipole, Da:	4.16
IP(EA), eV:	-9.5(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-quinoxalin-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CNC(=O)C=C(C)C2=CC=CC=C2

DOS

IR

Vibrations