Geometry & MOs

Info

ID:	213928
PubChem CID:	81065559
Reduced:	SN3O4C11H19 (1)
Stoich.:	AB3C4D11E19 (1)
Weight, g/mol:	358.955262
ΔH_f, kcal/mol:	-160.07
Dipole, Da:	6.95
IP(EA), eV:	-9.58(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)S(=O)(=O)NCC(C)CC(=O)O

DOS

IR

Vibrations