Geometry & MOs

Info

ID:	362723
PubChem CID:	127309268
Reduced:	ON5C22H25 (1)
Stoich.:	AB5C22D25 (1)
Weight, g/mol:	378.194343
ΔH_f, kcal/mol:	36.52
Dipole, Da:	2.97
IP(EA), eV:	-8.84(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methyl]-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

C1CC2CN(CCN2C1)C(=O)NCC3=CC=C(C=C3)N4C=NC5=CC=CC=C54

DOS

IR

Vibrations