Geometry & MOs

Info

ID:	392483
PubChem CID:	135016882
Reduced:	NO2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	282.100442
ΔH_f, kcal/mol:	-25.05
Dipole, Da:	2.55
IP(EA), eV:	-8.09(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methoxy-2-methylphenyl)-6-nitro-1H-indole

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)OC)C2=CNC3=C2C(=CC=C3)OC

DOS

IR

Vibrations