Geometry & MOs

Info

ID:	401328
PubChem CID:	135050970
Reduced:	N2O6C17H22 (1)
Stoich.:	A2B6C17D22 (1)
Weight, g/mol:	398.147786
ΔH_f, kcal/mol:	-242.8
Dipole, Da:	2.9
IP(EA), eV:	-9.79(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-oxo-3-phenyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCC(=O)C(C(=O)OC)NC(=O)[C@H](C)NC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations