Geometry & MOs

Info

ID:	14679
PubChem CID:	417395
Reduced:	O2N3C7H9 (1)
Stoich.:	A2B3C7D9 (1)
Weight, g/mol:	167.069477
ΔH_f, kcal/mol:	-48.63
Dipole, Da:	5.58
IP(EA), eV:	-9.96(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-pyrimidin-2-ylpropanoic acid

Drug info:

PubChemData

Smile

C1=CN=C(N=C1)CC(C(=O)O)N

DOS

IR

Vibrations