Geometry & MOs

Info

ID:	396626
PubChem CID:	135028912
Reduced:	O5H34C40 (1)
Stoich.:	A5B34C40 (1)
Weight, g/mol:	299.061614
ΔH_f, kcal/mol:	-48.91
Dipole, Da:	6.96
IP(EA), eV:	-8.55(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methoxy-1-methylindol-3-yl)-2-thiophen-3-ylethane-1,2-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=CC(=C2C(=C1)OC)OCC3=CC=CC=C3)C4=C(C=C(C=C4OCC5=CC=CC=C5)OCC6=CC=CC=C6)C=O

DOS

IR

Vibrations