Geometry & MOs

Info

ID:	250889
PubChem CID:	103099734
Reduced:	ClN2S2O5C11H13 (1)
Stoich.:	AB2C2D5E11F13 (1)
Weight, g/mol:	364.935005
ΔH_f, kcal/mol:	-183.53
Dipole, Da:	11.13
IP(EA), eV:	-9.97(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-[(5-chloro-4-methylthiophen-2-yl)sulfonylamino]benzoic acid

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)N2CCNC(=O)C2CC(=O)O)Cl

DOS

IR

Vibrations