Geometry & MOs

Info

ID:	339826
PubChem CID:	127261835
Reduced:	O2N4C17H24 (1)
Stoich.:	A2B4C17D24 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-71.03
Dipole, Da:	5.92
IP(EA), eV:	-8.73(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)-N-(4-phenylbutyl)propanamide

Drug info:

PubChemData

Smile

CCCN([C@@H](C)C(=O)N)C(=O)[C@H](CC1=CNC2=CC=CC=C21)N

DOS

IR

Vibrations