Geometry & MOs

Info

ID:	32530
PubChem CID:	7842196
Reduced:	FN2O3H21C25 (1)
Stoich.:	AB2C3D21E25 (1)
Weight, g/mol:	402.1591
ΔH_f, kcal/mol:	-59.59
Dipole, Da:	4.35
IP(EA), eV:	-8.7(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 2-(2-fluorophenoxy)acetate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCOC(=O)C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

DOS

IR

Vibrations