Geometry & MOs

Info

ID:	32737
PubChem CID:	7847581
Reduced:	BrSN2O4C16H17 (1)
Stoich.:	ABC2D4E16F17 (1)
Weight, g/mol:	343.02079
ΔH_f, kcal/mol:	-106.54
Dipole, Da:	7.36
IP(EA), eV:	-9.53(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenoxy)-1-(2-methyl-1H-indol-3-yl)ethanone

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC=C2Br

DOS

IR

Vibrations