Geometry & MOs

Info

ID:	341168
PubChem CID:	127263603
Reduced:	BrClNOH11C15 (1)
Stoich.:	ABCDE11F15 (1)
Weight, g/mol:	315.02588
ΔH_f, kcal/mol:	11.95
Dipole, Da:	3.3
IP(EA), eV:	-8.91(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-2-(3-methoxyphenyl)-5-methyl-1H-indole

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=CC3=CC(=CC(=C3N2)Br)Cl

DOS

IR

Vibrations