Geometry & MOs

Info

ID:	202935
PubChem CID:	79748191
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	252.162649
ΔH_f, kcal/mol:	-50.17
Dipole, Da:	4.31
IP(EA), eV:	-8.9(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(phenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCC1=CN=C(C=C1)CC(CC2CCCO2)NCC

DOS

IR

Vibrations