Geometry & MOs

Info

ID:	201564
PubChem CID:	79556836
Reduced:	ClO2N3C15H16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	317.96654
ΔH_f, kcal/mol:	51.02
Dipole, Da:	6.33
IP(EA), eV:	-8.89(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-fluoro-4-methylphenyl)-4-iodo-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

C1CC1C(C2=CN(C=C2)CC3=C(C=CC(=C3)Cl)[N+](=O)[O-])N

DOS

IR

Vibrations