Geometry & MOs

Info

ID:	435549
PubChem CID:	135191786
Reduced:	BrClSO3N4H10C13 (1)
Stoich.:	ABCD3E4F10G13 (1)
Weight, g/mol:	410.94887
ΔH_f, kcal/mol:	-29.09
Dipole, Da:	2.66
IP(EA), eV:	-9.37(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-N-(4-cyano-2,5-difluorophenyl)-1H-indole-3-sulfonamide

Drug info:

PubChemData

Smile

COC1=C(N=CC(=C1)Br)NS(=O)(=O)C2=CNC3=C2C=CC(=N3)Cl

DOS

IR

Vibrations