Geometry & MOs

Info

ID:	289512
PubChem CID:	104359213
Reduced:	BrClSN2O3C13H16 (1)
Stoich.:	ABCD2E3F13G16 (1)
Weight, g/mol:	395.95462
ΔH_f, kcal/mol:	-116.07
Dipole, Da:	3.23
IP(EA), eV:	-10.02(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-chloro-N-(oxolan-3-ylmethyl)-5-sulfamoylbenzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C2=C(C(=CC(=C2)S(=O)(=O)N)Br)Cl

DOS

IR

Vibrations