Geometry & MOs

Info

ID:	271018
PubChem CID:	103640338
Reduced:	N3O3C14H15 (1)
Stoich.:	A3B3C14D15 (1)
Weight, g/mol:	361.957
ΔH_f, kcal/mol:	-69.06
Dipole, Da:	3.92
IP(EA), eV:	-8.72(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(3-chloroquinoxalin-2-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)C)C(=O)OC

DOS

IR

Vibrations