Geometry & MOs

Info

ID:	190942
PubChem CID:	78081254
Reduced:	N2O5C20H28 (1)
Stoich.:	A2B5C20D28 (1)
Weight, g/mol:	378.194343
ΔH_f, kcal/mol:	-188.6
Dipole, Da:	8.65
IP(EA), eV:	-8.82(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-benzyl-3-[2-[4-(hydroxymethyl)phenyl]acetyl]-3,6-diazabicyclo[3.2.2]nonan-7-one

Drug info:

PubChemData

Smile

COCCN1C2CCC(C1=O)CN(C2)C(=O)CC3=C(C(=CC=C3)OC)OC

DOS

IR

Vibrations