Geometry & MOs

Info

ID:	136413
PubChem CID:	52035712
Reduced:	ON6H18C19 (1)
Stoich.:	AB6C18D19 (1)
Weight, g/mol:	370.074515
ΔH_f, kcal/mol:	65.89
Dipole, Da:	6.25
IP(EA), eV:	-8.61(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-2-fluorophenyl)-2-([1,2,4]triazolo[4,3-a]quinoxalin-4-ylamino)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CNC2=NC3=CC=CC=C3N4C2=NN=C4)C

DOS

IR

Vibrations