Geometry & MOs

Info

ID:	338072
PubChem CID:	127258703
Reduced:	NO4C9H15 (1)
Stoich.:	AB4C9D15 (1)
Weight, g/mol:	199.084458
ΔH_f, kcal/mol:	-142.13
Dipole, Da:	3.8
IP(EA), eV:	-9.72(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E)-2-prop-2-enoxyiminoethyl] 3-oxobutanoate

Drug info:

PubChemData

Smile

CCCO/N=C\COC(=O)CC(=O)C

DOS

IR

Vibrations