Geometry & MOs

Info

ID:	22685
PubChem CID:	598362
Reduced:	SN2O5C15H22 (1)
Stoich.:	AB2C5D15E22 (1)
Weight, g/mol:	342.124943
ΔH_f, kcal/mol:	-211.32
Dipole, Da:	4.59
IP(EA), eV:	-9.65(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[4-[(4-methylphenyl)sulfonylamino]butanoylamino]acetate

Drug info:

PubChemData

Smile

CCOC(=O)CNC(=O)CCCNS(=O)(=O)C1=CC=C(C=C1)C

DOS

IR

Vibrations