Geometry & MOs

Info

ID:	64773
PubChem CID:	29203981
Reduced:	NSO3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	378.02489
ΔH_f, kcal/mol:	-128.35
Dipole, Da:	4.52
IP(EA), eV:	-9.74(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-butyl-5-[methoxy(methyl)sulfamoyl]benzamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C1=CC=CC(=C1)CS(=O)(=O)C

DOS

IR

Vibrations