Geometry & MOs

Info

ID:	277577
PubChem CID:	103829601
Reduced:	FNO3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	254.106671
ΔH_f, kcal/mol:	-137.32
Dipole, Da:	3.57
IP(EA), eV:	-8.98(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCNC(=O)C2=C(C=C(C=C2)F)O

DOS

IR

Vibrations