Geometry & MOs

Info

ID:	158492
PubChem CID:	56464048
Reduced:	N2S2O5C18H22 (1)
Stoich.:	A2B2C5D18E22 (1)
Weight, g/mol:	377.093309
ΔH_f, kcal/mol:	-157.31
Dipole, Da:	4.11
IP(EA), eV:	-8.95(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]benzoic acid

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2

DOS

IR

Vibrations