Geometry & MOs

Info

ID:	399602
PubChem CID:	135041224
Reduced:	F2O2H10C13 (1)
Stoich.:	A2B2C10D13 (1)
Weight, g/mol:	251.131014
ΔH_f, kcal/mol:	-124.87
Dipole, Da:	3.71
IP(EA), eV:	-9.46(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methoxy-2-methylphenyl)-5-methyl-1H-indole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C2C(C=CC(=O)O2)(F)F

DOS

IR

Vibrations