Geometry & MOs

Info

ID:	142730
PubChem CID:	53082515
Reduced:	SO2N5H19C20 (1)
Stoich.:	AB2C5D19E20 (1)
Weight, g/mol:	367.090309
ΔH_f, kcal/mol:	59.08
Dipole, Da:	5.09
IP(EA), eV:	-8.38(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-fluoro-2-methylphenyl)-2-([1,2,4]triazolo[4,3-a]quinoxalin-4-ylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=CSC(=N2)C3=C(N(N=N3)C4=CC(=CC=C4)OC)N

DOS

IR

Vibrations