Geometry & MOs

Info

ID:	121365
PubChem CID:	50765346
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	321.147727
ΔH_f, kcal/mol:	-17.96
Dipole, Da:	1.08
IP(EA), eV:	-8.32(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 3-anilinoquinoxaline-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2C(=O)OCC(C)C

DOS

IR

Vibrations