Geometry & MOs

Info

ID:	369689
PubChem CID:	127335023
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	349.142641
ΔH_f, kcal/mol:	-38.71
Dipole, Da:	4.31
IP(EA), eV:	-8.87(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(3-hydroxy-8-azabicyclo[3.2.1]octane-8-carbonyl)phenoxy]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)CN3C(=O)CCC4=CC=CC=C43)O

DOS

IR

Vibrations