Geometry & MOs

Info

ID:	355881
PubChem CID:	127290733
Reduced:	ON2C14H18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	231.125929
ΔH_f, kcal/mol:	-17.96
Dipole, Da:	5.22
IP(EA), eV:	-8.92(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dihydroisoindol-2-yl-(1-hydroxycyclopentyl)methanone

Drug info:

PubChemData

Smile

CN1CCC(C1)C(=O)N2CC3=CC=CC=C3C2

DOS

IR

Vibrations