Geometry & MOs

Info

ID:	391284
PubChem CID:	135004114
Reduced:	NSeO4C16H19 (1)
Stoich.:	ABC4D16E19 (1)
Weight, g/mol:	219.069557
ΔH_f, kcal/mol:	29.57
Dipole, Da:	6.28
IP(EA), eV:	-9.14(-3.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorobut-2-enyl)isoindole-1,3-dione

Drug info:

PubChemData

Smile

CCOC(=O)C(CC[Se](=O)(=O)C1=CC=CC=C1)(CC=C)C#N

DOS

IR

Vibrations