Geometry & MOs

Info

ID:	9664
PubChem CID:	92124
Reduced:	NSO2C6H13 (1)
Stoich.:	ABC2D6E13 (1)
Weight, g/mol:	163.0667
ΔH_f, kcal/mol:	-103.57
Dipole, Da:	3.79
IP(EA), eV:	-8.96(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-4-ethylsulfanylbutanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations