Geometry & MOs

Info

ID:	190607
PubChem CID:	78028367
Reduced:	FN3O6C22H24 (1)
Stoich.:	AB3C6D22E24 (1)
Weight, g/mol:	290.143056
ΔH_f, kcal/mol:	-275.67
Dipole, Da:	5.5
IP(EA), eV:	-8.89(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(aminomethyl)-2-fluorohept-2-enyl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC(C(=O)OCCN1C(=O)CCC(C1=O)N2C(=O)C3=C(C2=O)C(=CC=C3)F)N4CCCC4

DOS

IR

Vibrations