Geometry & MOs

Info

ID:	322845
PubChem CID:	126671448
Reduced:	ON2C26H36 (1)
Stoich.:	AB2C26D36 (1)
Weight, g/mol:	425.98652
ΔH_f, kcal/mol:	-20.43
Dipole, Da:	2.17
IP(EA), eV:	-8.46(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(1-benzofuran-2-yl)-1-iodoindol-2-yl]-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@@H]1CN([C@H](CN1CC2=CC=C(C=C2)C3=CC=C(C=C3)COC4CCCC4)C)C

DOS

IR

Vibrations