Geometry & MOs

Info

ID:	361314
PubChem CID:	127302509
Reduced:	ClFN2O2C14H16 (1)
Stoich.:	ABC2D2E14F16 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-45.46
Dipole, Da:	8.22
IP(EA), eV:	-8.91(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[3-(morpholine-4-carbonyl)phenyl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)NC3=CC(=C(C=C3)Cl)F)O

DOS

IR

Vibrations