Geometry & MOs

Info

ID:	287575
PubChem CID:	104247580
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	221.105193
ΔH_f, kcal/mol:	-110.3
Dipole, Da:	3.66
IP(EA), eV:	-8.57(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-oxo-6,7-dihydro-5H-cyclopenta[b]pyridin-1-yl)butanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(=C)CN1C2=C(CCC2)C=CC1=O

DOS

IR

Vibrations