Geometry & MOs

Info

ID:	222850
PubChem CID:	85332733
Reduced:	NO17C20H33 (1)
Stoich.:	AB17C20D33 (1)
Weight, g/mol:	559.086526
ΔH_f, kcal/mol:	-764.97
Dipole, Da:	3.85
IP(EA), eV:	-10.32(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-2-[(5-piperazin-1-yloxythiophen-2-yl)sulfonylamino]-5-(1,1,3-trioxo-1,2-benzothiazol-2-yl)pentanamide

Drug info:

PubChemData

Smile

CC(=O)NC1C(C(C(OC1OC2C(C(OC(C2O)OC3C(OC(C(C3O)O)O)CO)CO)O)C(=O)O)O)O

DOS

IR

Vibrations