Geometry & MOs

Info

ID:	134538
PubChem CID:	51711802
Reduced:	O3N4C9H14 (1)
Stoich.:	A3B4C9D14 (1)
Weight, g/mol:	180.066068
ΔH_f, kcal/mol:	-72.35
Dipole, Da:	7.75
IP(EA), eV:	-9.09(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-(4-aminophenoxy)propanoate

Drug info:

PubChemData

Smile

CN(C)NC(=O)C[C@@H](C(=O)[O-])[N+]1=CNC=C1

DOS

IR

Vibrations