Geometry & MOs

Info

ID:	372075
PubChem CID:	131292836
Reduced:	N2F3O3H5C7 (1)
Stoich.:	A2B3C3D5E7 (1)
Weight, g/mol:	209.116427
ΔH_f, kcal/mol:	-169.07
Dipole, Da:	2.94
IP(EA), eV:	-11.17(-2.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-piperidin-2-yl-1,3-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C1=C(C(=C(C=N1)C(F)(F)F)[N+](=O)[O-])CO

DOS

IR

Vibrations