Geometry & MOs

Info

ID:	14358
PubChem CID:	410009
Reduced:	ClS2N3O4H6C7 (1)
Stoich.:	AB2C3D4E6F7 (1)
Weight, g/mol:	294.948826
ΔH_f, kcal/mol:	-106.2
Dipole, Da:	4.22
IP(EA), eV:	-9.91(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-2-hydroxy-2-oxo-2lambda6-thia-3,5-diazabicyclo[4.4.0]deca-1,3,5,7,9-pentaene-9-sulfonamide

Drug info:

PubChemData

Smile

C1=C(C(=CC2=NC=NS(=C21)(=O)O)Cl)S(=O)(=O)N

DOS

IR

Vibrations