Geometry & MOs

Info

ID:	288621
PubChem CID:	104321736
Reduced:	NO2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-79.1
Dipole, Da:	4.27
IP(EA), eV:	-10.07(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])O

DOS

IR

Vibrations