Geometry & MOs

Info

ID:	178589
PubChem CID:	76353300
Reduced:	SN4O5C23H30 (1)
Stoich.:	AB4C5D23E30 (1)
Weight, g/mol:	334.146347
ΔH_f, kcal/mol:	-187.41
Dipole, Da:	5.09
IP(EA), eV:	-8.35(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-propylpyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC2=C(C=CC=C21)NC(=O)C3CC(=O)NC4C3CC(CC4)S(=O)(=O)N5CCOCC5

DOS

IR

Vibrations