Geometry & MOs

Info

ID:	259947
PubChem CID:	103178288
Reduced:	N3O4C13H21 (1)
Stoich.:	A3B4C13D21 (1)
Weight, g/mol:	251.119129
ΔH_f, kcal/mol:	-143.2
Dipole, Da:	2.69
IP(EA), eV:	-9.28(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxypropoxy)ethyl 2-amino-4-sulfanylbutanoate

Drug info:

PubChemData

Smile

COCCCOCCOC(=O)C1CC2=C(CN1)NC=N2

DOS

IR

Vibrations