Geometry & MOs

Info

ID:	123281
PubChem CID:	50840564
Reduced:	O3N4C24H28 (1)
Stoich.:	A3B4C24D28 (1)
Weight, g/mol:	438.183795
ΔH_f, kcal/mol:	-54.86
Dipole, Da:	5.91
IP(EA), eV:	-8.24(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-piperidin-1-ylsulfonyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoxaline

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)N4CCCCCC4

DOS

IR

Vibrations