Geometry & MOs

Info

ID:	127342
PubChem CID:	50998977
Reduced:	NOC8H19 (1)
Stoich.:	ABC8D19 (1)
Weight, g/mol:	215.071306
ΔH_f, kcal/mol:	-85.23
Dipole, Da:	1.44
IP(EA), eV:	-9.39(2.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-3-amino-2-methyl-3-phenylpropanoic acid;hydrochloride

Drug info:

PubChemData

Smile

CC[C@H](C[C@@H](C(C)C)O)N

DOS

IR

Vibrations