Geometry & MOs

Info

ID:	439158
PubChem CID:	135228923
Reduced:	N2C27H30 (1)
Stoich.:	A2B27C30 (1)
Weight, g/mol:	389.98652
ΔH_f, kcal/mol:	93.39
Dipole, Da:	7.95
IP(EA), eV:	-7.64(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-yl)-2-(6-iodo-5H-imidazo[5,1-a]isoindol-5-yl)ethanone

Drug info:

PubChemData

Smile

C/C=C(\C=C)/C1=CC2=C(C=C1C)C3=CC(=C)C(=CN3C(C2)C(C)(C)C)C(=C)C#N

DOS

IR

Vibrations