Geometry & MOs

Info

ID:	84525
PubChem CID:	49867261
Reduced:	NO3C5H9 (1)
Stoich.:	AB3C5D9 (1)
Weight, g/mol:	165.045964
ΔH_f, kcal/mol:	-126.31
Dipole, Da:	5.02
IP(EA), eV:	-10.4(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-4-(hydroxymethylsulfanyl)butanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations