Geometry & MOs

Info

ID:	197566
PubChem CID:	78978527
Reduced:	NCl2O3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-118.84
Dipole, Da:	4.09
IP(EA), eV:	-9.64(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-(4-nitrophenyl)ethyl-prop-2-enylamino]acetate

Drug info:

PubChemData

Smile

CCOC(=O)CN(CC=C)C(=O)CC1=C(C=CC=C1Cl)Cl

DOS

IR

Vibrations