Geometry & MOs

Info

ID:	11060
PubChem CID:	110416
Reduced:	SN2O7H12C17 (1)
Stoich.:	AB2C7D12E17 (1)
Weight, g/mol:	388.036522
ΔH_f, kcal/mol:	-112.72
Dipole, Da:	6.43
IP(EA), eV:	-9.75(-2.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[4-(dihydroxyamino)benzoyl]imino-3-oxonaphthalene-1-sulfonic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N=C2C=CC3=CC(=O)C=C(C3=C2)S(=O)(=O)O)N(O)O

DOS

IR

Vibrations