Geometry & MOs

Info

ID:	259056
PubChem CID:	103158108
Reduced:	NO3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	233.162708
ΔH_f, kcal/mol:	-170.09
Dipole, Da:	2.16
IP(EA), eV:	-9.45(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butoxyethyl 4-amino-3-methoxybutanoate

Drug info:

PubChemData

Smile

CCCCCCCOC(=O)CC(CN)OC

DOS

IR

Vibrations