Geometry & MOs

Info

ID:	288572
PubChem CID:	104320008
Reduced:	ClO2N3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	266.082205
ΔH_f, kcal/mol:	-77.06
Dipole, Da:	3.25
IP(EA), eV:	-9.57(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1=NC=C(C(=N1)C(=O)N2CC3CCC(C3C2)O)Cl

DOS

IR

Vibrations