Geometry & MOs

Info

ID:	369700
PubChem CID:	127335053
Reduced:	O3N4C16H20 (1)
Stoich.:	A3B4C16D20 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	7.85
Dipole, Da:	6.96
IP(EA), eV:	-8.81(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-3-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)CCN3C(=O)N4C=CC=CC4=N3)O

DOS

IR

Vibrations