Geometry & MOs

Info

ID:	183208
PubChem CID:	76991288
Reduced:	N2O3C10H14 (1)
Stoich.:	A2B3C10D14 (1)
Weight, g/mol:	241.131408
ΔH_f, kcal/mol:	-102.44
Dipole, Da:	1.91
IP(EA), eV:	-10.18(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-dimethylmorpholin-4-yl)-2,3-dimethyl-4-oxobut-2-enoic acid

Drug info:

PubChemData

Smile

CC(=C(C)C(=O)O)C(=O)N(C)CCC#N

DOS

IR

Vibrations