Geometry & MOs

Info

ID:	222292
PubChem CID:	85296335
Reduced:	NOH19C23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	325.123342
ΔH_f, kcal/mol:	43.79
Dipole, Da:	3.56
IP(EA), eV:	-8.5(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-chlorophenyl)-7-phenyl-6-azabicyclo[3.2.2]nonan-8-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C(=O)C2=CC3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations