Geometry & MOs

Info

ID:	131792
PubChem CID:	51261551
Reduced:	FNO4C20H24 (1)
Stoich.:	ABC4D20E24 (1)
Weight, g/mol:	372.089226
ΔH_f, kcal/mol:	-164.12
Dipole, Da:	6.25
IP(EA), eV:	-8.36(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylsulfonylphenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide

Drug info:

PubChemData

Smile

COC1=C2CN(CC(C2=C(C=C1)OC)O)CCCOC3=CC=C(C=C3)F

DOS

IR

Vibrations