Geometry & MOs

Info

ID:	137573
PubChem CID:	52228867
Reduced:	N2O2C11H14 (2)
Stoich.:	A2B2C11D14 (2)
Weight, g/mol:	344.9913
ΔH_f, kcal/mol:	-105.37
Dipole, Da:	5.12
IP(EA), eV:	-8.92(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-4-fluorophenyl)quinoxaline-2-carboxamide

Drug info:

PubChemData

Smile

CCN(C[C@@H]1COC2=CC=CC=C2O1)C(=O)NCC3=C(N=CC=C3)N4CCOCC4

DOS

IR

Vibrations