Geometry & MOs

Info

ID:	202883
PubChem CID:	79738113
Reduced:	ON2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	229.146664
ΔH_f, kcal/mol:	-31.74
Dipole, Da:	2.72
IP(EA), eV:	-8.83(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)cycloheptan-1-one

Drug info:

PubChemData

Smile

CCNCC(C1CCC2=C1N=CC=C2)O

DOS

IR

Vibrations