Geometry & MOs

Info

ID:	334507
PubChem CID:	127253182
Reduced:	ON3C21H25 (1)
Stoich.:	AB3C21D25 (1)
Weight, g/mol:	480.1452
ΔH_f, kcal/mol:	2.92
Dipole, Da:	4.98
IP(EA), eV:	-8.44(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,5'R)-7-chloro-3'-[2-(1H-indol-3-yl)ethylamino]-4,6-dimethoxy-5'-methylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione

Drug info:

PubChemData

Smile

C1CN(CC2=C1C3=CC=CC=C3N2)C(=O)CCCCCN4C=CC=C4

DOS

IR

Vibrations