Geometry & MOs

Info

ID:	339848
PubChem CID:	127261857
Reduced:	NO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	350.184172
ΔH_f, kcal/mol:	-79.85
Dipole, Da:	2.23
IP(EA), eV:	-8.85(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-1-phenylbutyl] (2S)-2-aminopropanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)N/C=C/1\C(=O)C=CC2=CC=CC=C21

DOS

IR

Vibrations