Geometry & MOs

Info

ID:	189871
PubChem CID:	77917931
Reduced:	FN3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	372.221306
ΔH_f, kcal/mol:	-170.32
Dipole, Da:	2.54
IP(EA), eV:	-9.45(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4-fluorophenyl)butanoyl]-6-(3-methylbut-2-enyl)-3,6-diazabicyclo[3.2.2]nonan-7-one

Drug info:

PubChemData

Smile

C1CC(CC1C(=O)NCC2=CC=C(C=C2)F)NC(=O)N3CCOCC3

DOS

IR

Vibrations