Geometry & MOs

Info

ID:	339974
PubChem CID:	127261983
Reduced:	N3O5C16H23 (1)
Stoich.:	A3B5C16D23 (1)
Weight, g/mol:	391.247107
ΔH_f, kcal/mol:	-184.65
Dipole, Da:	2.9
IP(EA), eV:	-9.63(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-pentylamino]-2-oxoethyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC(=O)N([C@@H](CC1=CC=CC=C1)C(=O)N)O

DOS

IR

Vibrations