Geometry & MOs

Info

ID:	302335
PubChem CID:	124361283
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	468.262422
ΔH_f, kcal/mol:	-53.66
Dipole, Da:	9.65
IP(EA), eV:	-9.04(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-4-methyl-2-[[(2R)-2-[(2-phenoxyacetyl)amino]-3-phenylpropanoyl]amino]pentanoate

Drug info:

PubChemData

Smile

C[C@H]1[C@@H]2C3=CC=CC=C3CCN2C4=C(C1=O)C(=O)CCC4

DOS

IR

Vibrations