Geometry & MOs

Info

ID:	411258
PubChem CID:	135084071
Reduced:	OC4H8 (2)
Stoich.:	AB4C8 (2)
Weight, g/mol:	171.069557
ΔH_f, kcal/mol:	-94.36
Dipole, Da:	3.01
IP(EA), eV:	-9.12(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-4-fluorobut-2-enoyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCCC[C@@H](/C=C/OC)O

DOS

IR

Vibrations