Geometry & MOs

Info

ID:	150561
PubChem CID:	53790254
Reduced:	ON3C5H7 (1)
Stoich.:	AB3C5D7 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	44.02
Dipole, Da:	6.29
IP(EA), eV:	-8.8(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl)-1-benzofuran-5-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1=CN=CC1=C(N)NO

DOS

IR

Vibrations