Geometry & MOs

Info

ID:	64780
PubChem CID:	29203990
Reduced:	SN3O3C18H29 (1)
Stoich.:	AB3C3D18E29 (1)
Weight, g/mol:	309.114713
ΔH_f, kcal/mol:	-124.4
Dipole, Da:	8.73
IP(EA), eV:	-9.15(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]acetamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)N2CCCCC2

DOS

IR

Vibrations