Geometry & MOs

Info

ID:	197789
PubChem CID:	78996955
Reduced:	N3O4C13H17 (1)
Stoich.:	A3B4C13D17 (1)
Weight, g/mol:	287.188529
ΔH_f, kcal/mol:	-68.19
Dipole, Da:	6.86
IP(EA), eV:	-9.51(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]bicyclo[2.2.1]heptan-2-amine

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)N2CCN(C(=O)C2)C)[N+](=O)[O-])O

DOS

IR

Vibrations