Geometry & MOs

Info

ID:	439178
PubChem CID:	135228943
Reduced:	IO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	280.193949
ΔH_f, kcal/mol:	-75.43
Dipole, Da:	4.4
IP(EA), eV:	-9.53(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-cyclohexylpropyl)-5H-imidazo[5,1-a]isoindole

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CC(=O)C2C=CC=CC2I)O

DOS

IR

Vibrations