Geometry & MOs

Info

ID:	35793
PubChem CID:	7980332
Reduced:	N2O6H16C17 (1)
Stoich.:	A2B6C16D17 (1)
Weight, g/mol:	345.137636
ΔH_f, kcal/mol:	-126.81
Dipole, Da:	3.74
IP(EA), eV:	-9.2(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[2-(4-fluorophenyl)ethylamino]-1-oxopropan-2-yl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations