Geometry & MOs

Info

ID:	340543
PubChem CID:	127262554
Reduced:	NH9C13 (2)
Stoich.:	AB9C13 (2)
Weight, g/mol:	238.074228
ΔH_f, kcal/mol:	179.9
Dipole, Da:	1.93
IP(EA), eV:	-8.49(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-nitro-5-phenyl-1H-indole

Drug info:

PubChemData

Smile

C1C=CC=C2C1=NC3=CC=CC(C3=C4C2=NC5=CC=CC=C54)C6=CC=CC=C6

DOS

IR

Vibrations