Geometry & MOs

Info

ID:	200867
PubChem CID:	79457042
Reduced:	SN3O4C10H15 (1)
Stoich.:	AB3C4D10E15 (1)
Weight, g/mol:	249.103479
ΔH_f, kcal/mol:	-140.34
Dipole, Da:	4.35
IP(EA), eV:	-9.86(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(2-butylsulfanylacetyl)amino]ethoxy]acetic acid

Drug info:

PubChemData

Smile

CC(C1=NC(=CS1)C(=O)NCCOCC(=O)O)N

DOS

IR

Vibrations