Geometry & MOs

Info

ID:	231762
PubChem CID:	87574613
Reduced:	SN4O4C17H32 (1)
Stoich.:	AB4C4D17E32 (1)
Weight, g/mol:	191.061614
ΔH_f, kcal/mol:	-210.15
Dipole, Da:	6.04
IP(EA), eV:	-8.81(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCC(CCNC(=O)OC(C)(C)C)(CN)N=C=S

DOS

IR

Vibrations