Geometry & MOs

Info

ID:	441141
PubChem CID:	135233284
Reduced:	NO2C20H29 (1)
Stoich.:	AB2C20D29 (1)
Weight, g/mol:	421.247775
ΔH_f, kcal/mol:	-65.79
Dipole, Da:	3.08
IP(EA), eV:	-8.24(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(3-aminobenzoyl)piperidin-3-yl]-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one

Drug info:

PubChemData

Smile

CCC(=C)N/C=C/CCC(C)C1=CC=C(C(=O)O1)C(=C)C(C)C

DOS

IR

Vibrations