Geometry & MOs

Info

ID:	13330
PubChem CID:	225701
Reduced:	NSO5H11C12 (1)
Stoich.:	ABC5D11E12 (1)
Weight, g/mol:	281.035794
ΔH_f, kcal/mol:	-181.71
Dipole, Da:	8.77
IP(EA), eV:	-9.11(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetamido-5-hydroxynaphthalene-1-sulfonic acid

Drug info:

PubChemData

Smile

CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=C2O

DOS

IR

Vibrations