Geometry & MOs

Info

ID:	287568
PubChem CID:	104247295
Reduced:	ClN2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	236.108026
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	1.86
IP(EA), eV:	-8.29(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(chloromethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine

Drug info:

PubChemData

Smile

CC(C)N(CCCl)C1=NC2=C(CCC2)C=C1

DOS

IR

Vibrations