Geometry & MOs

Info

ID:	44343
PubChem CID:	10502943
Reduced:	ClNSO5H20C21 (1)
Stoich.:	ABCD5E20F21 (1)
Weight, g/mol:	435.03999
ΔH_f, kcal/mol:	-133.96
Dipole, Da:	10.18
IP(EA), eV:	-8.37(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)C3=C(C(=CC(=C3OC)Cl)C)OC

DOS

IR

Vibrations