Geometry & MOs

Info

ID:	161714
PubChem CID:	57392410
Reduced:	ClON5C20H22 (1)
Stoich.:	ABC5D20E22 (1)
Weight, g/mol:	347.17461
ΔH_f, kcal/mol:	8.02
Dipole, Da:	5.41
IP(EA), eV:	-8.65(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-aminoquinoxalin-2-yl)-4-(pyrrolidin-1-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1CCN(C1)CC2=CC=C(C=C2)C(=O)NC3=NC4=CC=CC=C4N=C3N.Cl

DOS

IR

Vibrations