Geometry & MOs

Info

ID:	214044
PubChem CID:	81065902
Reduced:	SN2O4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	372.970912
ΔH_f, kcal/mol:	-133.02
Dipole, Da:	3.67
IP(EA), eV:	-10.15(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2,4,6-trichlorophenyl)sulfonylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNS(=O)(=O)CC1=CC=CC=C1C#N

DOS

IR

Vibrations