Geometry & MOs

Info

ID:	168184
PubChem CID:	74933981
Reduced:	S3N5O11H23C28 (1)
Stoich.:	A3B5C11D23E28 (1)
Weight, g/mol:	271.951059
ΔH_f, kcal/mol:	-257.71
Dipole, Da:	7.78
IP(EA), eV:	-8.47(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

zinc;2,3,4,5-tetrahydroxyhexanedioate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)OC)NN=C4C(=CC5=C(C4=O)C=CC(=C5)N)S(=O)(=O)O

DOS

IR

Vibrations