Geometry & MOs

Info

ID:	292918
PubChem CID:	117365089
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	245.116427
ΔH_f, kcal/mol:	-30.55
Dipole, Da:	5.58
IP(EA), eV:	-9.08(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-[3-(2-methylimidazol-1-yl)phenyl]propanoic acid

Drug info:

PubChemData

Smile

CN1C=CN=C1C2=CC=C(C=C2)C(CN)C(=O)O

DOS

IR

Vibrations