Geometry & MOs

Info

ID:	202893
PubChem CID:	79740079
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	226.110613
ΔH_f, kcal/mol:	-92.19
Dipole, Da:	3.8
IP(EA), eV:	-9.55(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CN=C(C=C1)CCCC(=O)OCC

DOS

IR

Vibrations