Geometry & MOs

Info

ID:	288581
PubChem CID:	104320236
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-83.38
Dipole, Da:	4.58
IP(EA), eV:	-9.36(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)methyl]-2-methoxybenzonitrile

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)C(=O)C(CC3=CC=CC=C3)N)O

DOS

IR

Vibrations