Geometry & MOs

Info

ID:	37467
PubChem CID:	8021388
Reduced:	FNO3H18C19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	307.121986
ΔH_f, kcal/mol:	-128.59
Dipole, Da:	4.93
IP(EA), eV:	-8.59(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)COC(=O)/C=C/C2=CC(=CC=C2)F

DOS

IR

Vibrations