Geometry & MOs

Info

ID:	30783
PubChem CID:	841875
Reduced:	ClN2O2F3H8C12 (1)
Stoich.:	AB2C2D3E8F12 (1)
Weight, g/mol:	244.084792
ΔH_f, kcal/mol:	-168.58
Dipole, Da:	4.31
IP(EA), eV:	-9.45(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetylphenyl)-5-methyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F

DOS

IR

Vibrations