Geometry & MOs

Info

ID:	325689
PubChem CID:	126684504
Reduced:	N2O3C17H26 (1)
Stoich.:	A2B3C17D26 (1)
Weight, g/mol:	493.203129
ΔH_f, kcal/mol:	-51.44
Dipole, Da:	4.09
IP(EA), eV:	-9.68(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S,4S)-5-[4-(5-chloro-2-fluorophenyl)phenyl]-2-(2-hydroxyethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NO1)CCCC(C)(C)C2=CC(=NO2)OC

DOS

IR

Vibrations