Geometry & MOs

Info

ID:	399180
PubChem CID:	135038513
Reduced:	OS2C11H14 (1)
Stoich.:	AB2C11D14 (1)
Weight, g/mol:	264.111007
ΔH_f, kcal/mol:	-4.06
Dipole, Da:	2.54
IP(EA), eV:	-7.7(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[formyl-[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]acetic acid

Drug info:

PubChemData

Smile

C1CSC(=S(C1)O)CC2=CC=CC=C2

DOS

IR

Vibrations