Geometry & MOs

Info

ID:	202895
PubChem CID:	79740218
Reduced:	NOCl2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	267.162314
ΔH_f, kcal/mol:	-25.85
Dipole, Da:	4.38
IP(EA), eV:	-9.55(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-(3,4-dimethylphenyl)ethanol

Drug info:

PubChemData

Smile

CCC1=CN=C(C=C1)CC(C2=C(C(=CC=C2)Cl)Cl)O

DOS

IR

Vibrations