Geometry & MOs

Info

ID:	147022
PubChem CID:	53777093
Reduced:	Cl2N2O2C23H24 (1)
Stoich.:	A2B2C2D23E24 (1)
Weight, g/mol:	143.058243
ΔH_f, kcal/mol:	-41.72
Dipole, Da:	4.81
IP(EA), eV:	-9.17(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-N-formylprop-2-enamide

Drug info:

PubChemData

Smile

CCCCOC(=O)[C@H](C1=CC=CC=C1)N(C)CC2=CC3=C(C=C2)C(=CN=C3Cl)Cl

DOS

IR

Vibrations