Geometry & MOs

Info

ID:	369289
PubChem CID:	127332277
Reduced:	BrSN2O2C9H11 (1)
Stoich.:	ABC2D2E9F11 (1)
Weight, g/mol:	280.12792
ΔH_f, kcal/mol:	-49.87
Dipole, Da:	4.44
IP(EA), eV:	-9.56(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-N,2,3-trimethylthiomorpholine-4-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1C=CC=C2Br)S(=O)(=O)N

DOS

IR

Vibrations