Geometry & MOs

Info

ID:	56686
PubChem CID:	21317902
Reduced:	ClNO3C9H18 (1)
Stoich.:	ABC3D9E18 (1)
Weight, g/mol:	187.120843
ΔH_f, kcal/mol:	-174.9
Dipole, Da:	5.24
IP(EA), eV:	-10.38(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-butoxy-3-iminopropanoate

Drug info:

PubChemData

Smile

CCCCOC(=N)CC(=O)OCC.Cl

DOS

IR

Vibrations