Geometry & MOs

Info

ID:	446591
PubChem CID:	135276262
Reduced:	O2N3C13H16 (2)
Stoich.:	A2B3C13D16 (2)
Weight, g/mol:	429.27399
ΔH_f, kcal/mol:	-77.3
Dipole, Da:	8.21
IP(EA), eV:	-8.17(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-ethanimidoyl-6,7-dimethoxy-3-propan-2-ylidenequinoxalin-2-yl)amino]-N-propan-2-ylpentanamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCCNC1=NC2=CC(=C(C=C2N3C1=NN=C3C4=CC=CC=C4)OC)OC

DOS

IR

Vibrations