Geometry & MOs

Info

ID:	189762
PubChem CID:	77901956
Reduced:	N2O2F3C15H19 (1)
Stoich.:	A2B2C3D15E19 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	-232.2
Dipole, Da:	8.96
IP(EA), eV:	-9.63(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-benzofuran-2-ylmethyl)-6-(1,3-thiazol-4-ylmethyl)-3,6-diazabicyclo[3.2.2]nonan-7-one

Drug info:

PubChemData

Smile

CCCC1CN(CC1C(=O)O)CC2=CN=C(C=C2)C(F)(F)F

DOS

IR

Vibrations