Geometry & MOs

Info

ID:	27270
PubChem CID:	820101
Reduced:	O3N4C11H16 (1)
Stoich.:	A3B4C11D16 (1)
Weight, g/mol:	211.074562
ΔH_f, kcal/mol:	-22.71
Dipole, Da:	12.45
IP(EA), eV:	-10.2(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1H-benzo[g]quinoxalin-2-one

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

DOS

IR

Vibrations