Geometry & MOs

Info

ID:	45419
PubChem CID:	10513009
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	218.13068
ΔH_f, kcal/mol:	7.42
Dipole, Da:	8.19
IP(EA), eV:	-9.22(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,9bS)-8-methoxy-4a-methyl-2,3,4,9b-tetrahydro-1H-dibenzofuran

Drug info:

PubChemData

Smile

CC1=NC2=C(N1CCCNC=O)C=CN=C2

DOS

IR

Vibrations