Geometry & MOs

Info

ID:	271285
PubChem CID:	103654048
Reduced:	BrN2O2S2C11H19 (1)
Stoich.:	AB2C2D2E11F19 (1)
Weight, g/mol:	313.126026
ΔH_f, kcal/mol:	-53.63
Dipole, Da:	5.25
IP(EA), eV:	-8.64(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[butan-2-yl(methyl)amino]ethyl]-3-cyano-4-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CCC(C)N(C)CCNS(=O)(=O)C1=C(C=CS1)Br

DOS

IR

Vibrations