Geometry & MOs

Info

ID:	261861
PubChem CID:	103255588
Reduced:	N2O3H12C14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	228.111007
ΔH_f, kcal/mol:	-23.8
Dipole, Da:	6.11
IP(EA), eV:	-8.96(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-3-methoxypropanoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(O2)C(=O)O)CNN3C=CC=C3

DOS

IR

Vibrations