Geometry & MOs

Info

ID:	201714
PubChem CID:	79570445
Reduced:	NOC15H27 (1)
Stoich.:	ABC15D27 (1)
Weight, g/mol:	235.193614
ΔH_f, kcal/mol:	-80.09
Dipole, Da:	3.47
IP(EA), eV:	-8.46(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)ethyl]cyclopentan-1-one

Drug info:

PubChemData

Smile

CC1(CCCN(CC1)CCC2CCCC2=O)C

DOS

IR

Vibrations