Geometry & MOs

Info

ID:	347167
PubChem CID:	127271708
Reduced:	SO4N5C16H19 (1)
Stoich.:	AB4C5D16E19 (1)
Weight, g/mol:	398.108248
ΔH_f, kcal/mol:	-17.31
Dipole, Da:	5.06
IP(EA), eV:	-9.14(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-tert-butylpyrazol-4-yl)-4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(N=C3)ON=C4C

DOS

IR

Vibrations