Geometry & MOs

Info

ID:	153894
PubChem CID:	56313229
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	473.175084
ΔH_f, kcal/mol:	-6.84
Dipole, Da:	3.54
IP(EA), eV:	-8.85(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[4-(3-ethyl-2,6-dioxopiperidin-3-yl)phenyl]-3-(3-fluoro-4-pyridin-3-yloxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(C)C(=O)N2CCC(CC2)C3=CNC4=C3C=CC=N4

DOS

IR

Vibrations