Geometry & MOs

Info

ID:	341167
PubChem CID:	127263602
Reduced:	BrNH12C15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	334.97125
ΔH_f, kcal/mol:	53.01
Dipole, Da:	1.24
IP(EA), eV:	-8.57(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)Br)NC(=C2)C3=CC=CC=C3

DOS

IR

Vibrations