Geometry & MOs

Info

ID:	249429
PubChem CID:	103089378
Reduced:	NSO3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	233.108565
ΔH_f, kcal/mol:	-160.78
Dipole, Da:	4.32
IP(EA), eV:	-8.76(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[formyl(propan-2-yl)amino]-5-methylsulfanylpentanoic acid

Drug info:

PubChemData

Smile

CC(C)N(C(CCCSC)C(=O)O)C(=O)C

DOS

IR

Vibrations