Geometry & MOs

Info

ID:	339950
PubChem CID:	127261959
Reduced:	O3N4C29H30 (1)
Stoich.:	A3B4C29D30 (1)
Weight, g/mol:	385.216555
ΔH_f, kcal/mol:	-20.21
Dipole, Da:	6.97
IP(EA), eV:	-8.96(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-N-[(4-fluorophenyl)methyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)[C@@H](CC2=CC=CC=C2)C(=O)NC(=O)[C@@H](CC3=CN(C4=CC=CC=C43)C=O)N

DOS

IR

Vibrations