Geometry & MOs

Info

ID:	294450
PubChem CID:	117461834
Reduced:	N2O3C16H18 (1)
Stoich.:	A2B3C16D18 (1)
Weight, g/mol:	286.131742
ΔH_f, kcal/mol:	-53.06
Dipole, Da:	3.06
IP(EA), eV:	-9.28(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(1-methylpiperidin-4-yl)phenyl]-1,2-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CC=C(C=C1)N2C(=CC=N2)C3CC3)O

DOS

IR

Vibrations