Geometry & MOs

Info

ID:	319415
PubChem CID:	126655930
Reduced:	BrNSO2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	285.01531
ΔH_f, kcal/mol:	-10.29
Dipole, Da:	3.77
IP(EA), eV:	-8.72(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromophenyl)-3-methylindole

Drug info:

PubChemData

Smile

CC1=CN(C2=CC=CC=C12)S(=O)(=O)C3=CC(=CC=C3)Br

DOS

IR

Vibrations