Geometry & MOs

Info

ID:	48452
PubChem CID:	10584890
Reduced:	FPO3C9H12 (1)
Stoich.:	ABC3D9E12 (1)
Weight, g/mol:	218.069142
ΔH_f, kcal/mol:	-213.38
Dipole, Da:	0.82
IP(EA), eV:	-9.53(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-oxo-4H-1,3-oxazol-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

COP(=O)(CC1=CC=CC=C1F)OC

DOS

IR

Vibrations