Geometry & MOs

Info

ID:	150607
PubChem CID:	53790300
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	245.001034
ΔH_f, kcal/mol:	-64.7
Dipole, Da:	2.35
IP(EA), eV:	-8.59(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(2,6-dichloropyridin-4-yl)prop-2-enoate

Drug info:

PubChemData

Smile

C1CC2=C(C(C1O)O)NC3=CC=CC=C23

DOS

IR

Vibrations