Geometry & MOs

Info

ID:	362708
PubChem CID:	127309185
Reduced:	N3O3C20H27 (1)
Stoich.:	A3B3C20D27 (1)
Weight, g/mol:	268.178693
ΔH_f, kcal/mol:	-104.87
Dipole, Da:	7.69
IP(EA), eV:	-9.32(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-(oxan-2-ylmethyl)-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CNC(=O)NC2CCC(CC2)OC3=CC=CC=C3C#N

DOS

IR

Vibrations