Geometry & MOs

Info

ID:	212161
PubChem CID:	81059686
Reduced:	ON2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	201.100108
ΔH_f, kcal/mol:	-26.09
Dipole, Da:	1.72
IP(EA), eV:	-8.85(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[2-ethoxyethyl(methyl)amino]-4-oxobut-2-enoic acid

Drug info:

PubChemData

Smile

CCOCCN(C)C(CCN)C1=CC=CC=C1

DOS

IR

Vibrations