Geometry & MOs

Info

ID:	172031
PubChem CID:	75455884
Reduced:	ClFSN3O3H15C18 (1)
Stoich.:	ABCD3E3F15G18 (1)
Weight, g/mol:	358.078742
ΔH_f, kcal/mol:	-111.2
Dipole, Da:	7.32
IP(EA), eV:	-8.19(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-dihydronaphthalen-2-ylsulfonyl)-8-fluoro-1,3-dihydroquinoxalin-2-one

Drug info:

PubChemData

Smile

CN(CC1=C(C=CC=C1Cl)F)C(=O)COC(=O)C2=C(C3=C(S2)N=CC=C3)N

DOS

IR

Vibrations