Geometry & MOs

Info

ID:	439202
PubChem CID:	135228967
Reduced:	NOC18H23 (1)
Stoich.:	ABC18D23 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	3.63
Dipole, Da:	2.74
IP(EA), eV:	-8.99(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-cyclohexyl-2-(6,7-dihydro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl] acetate

Drug info:

PubChemData

Smile

C=N/C=C/C1=CC=CC=C1CCC(C2CCC=CC2)O

DOS

IR

Vibrations