Geometry & MOs

Info

ID:	444567
PubChem CID:	135262881
Reduced:	NO4C17H21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	472.199822
ΔH_f, kcal/mol:	-169.39
Dipole, Da:	7.73
IP(EA), eV:	-8.84(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-acetyl-1,3-dihydroisoindol-5-yl)cyclopropanecarbonyl] 1-(2-acetyl-1,3-dihydroisoindol-5-yl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CCN1C=CC2=C1C=CC(=C2)CC(=O)O

DOS

IR

Vibrations