Geometry & MOs

Info

ID:	11124
PubChem CID:	111309
Reduced:	O2N3C8H13 (1)
Stoich.:	A2B3C8D13 (1)
Weight, g/mol:	183.100777
ΔH_f, kcal/mol:	-69.62
Dipole, Da:	4.69
IP(EA), eV:	-9.35(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-2-amino-3-(1H-imidazol-5-yl)propanoate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](CC1=CN=CN1)N

DOS

IR

Vibrations