Geometry & MOs

Info

ID:	291787
PubChem CID:	113499415
Reduced:	SN5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	292.064841
ΔH_f, kcal/mol:	56.08
Dipole, Da:	3.91
IP(EA), eV:	-8.64(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-chloro-N-(3-hydroxybutyl)-N-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCSCC(C)NC1=NC(=NC2=CC=CC=C21)NN

DOS

IR

Vibrations