Geometry & MOs

Info

ID:	9671
PubChem CID:	92173
Reduced:	ClNSO2C5H12 (1)
Stoich.:	ABCD2E5F12 (1)
Weight, g/mol:	185.027727
ΔH_f, kcal/mol:	-136.91
Dipole, Da:	5.91
IP(EA), eV:	-9.42(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-methyl-3-sulfanylbutanoic acid;hydrochloride

Drug info:

PubChemData

Smile

CC(C)([C@H](C(=O)O)N)S.Cl

DOS

IR

Vibrations