Geometry & MOs

Info

ID:	342044
PubChem CID:	127264757
Reduced:	N2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-32.29
Dipole, Da:	7.79
IP(EA), eV:	-9.3(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[(5-methylpyridin-3-yl)methyl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CCC=C(C)C(=O)NC1=C(C=CC(=C1)C#N)O

DOS

IR

Vibrations