Geometry & MOs

Info

ID:	417366
PubChem CID:	135092741
Reduced:	F2O3N4C16H20 (1)
Stoich.:	A2B3C4D16E20 (1)
Weight, g/mol:	351.159434
ΔH_f, kcal/mol:	-138.75
Dipole, Da:	1.41
IP(EA), eV:	-9.88(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-(2-hydroxy-2-methylpropyl)-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2OC)C(=O)C3=CC(=NN3C)C(F)F

DOS

IR

Vibrations