Geometry & MOs

Info

ID:	367932
PubChem CID:	127326106
Reduced:	FSO2N3C21H22 (1)
Stoich.:	ABC2D3E21F22 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	-72.68
Dipole, Da:	0.43
IP(EA), eV:	-8.56(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3-phenylthiomorpholin-4-yl)acetyl]-1,3-dihydroquinoxalin-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC3=C2C(=O)NC(=N3)CN4CCC(CC4)OC5=CC=C(C=C5)F

DOS

IR

Vibrations