Geometry & MOs

Info

ID:	120774
PubChem CID:	50744107
Reduced:	N3O4H23C25 (1)
Stoich.:	A3B4C23D25 (1)
Weight, g/mol:	397.179027
ΔH_f, kcal/mol:	-46.34
Dipole, Da:	0.88
IP(EA), eV:	-8.44(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-[2-(4-methylphenyl)ethylamino]quinoxaline-2-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)CNC2=NC3=CC=CC=C3N=C2C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations