Geometry & MOs

Info

ID:	227648
PubChem CID:	87562161
Reduced:	SO4N7C23H25 (1)
Stoich.:	AB4C7D23E25 (1)
Weight, g/mol:	361.055484
ΔH_f, kcal/mol:	-49.33
Dipole, Da:	4.36
IP(EA), eV:	-9.07(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(1,1-dihydroxy-2,3-dihydro-1,2-benzothiazol-6-yl)-1,3-benzothiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=NO1)CCNC(=O)NC2=NC3=C(S2)C=C(C=C3)C4=CC(=CN=C4)N(C)C(=O)O

DOS

IR

Vibrations