Geometry & MOs

Info

ID:	153290
PubChem CID:	56312468
Reduced:	FN3O3C27H28 (1)
Stoich.:	AB3C3D27E28 (1)
Weight, g/mol:	477.206385
ΔH_f, kcal/mol:	-65.31
Dipole, Da:	6.19
IP(EA), eV:	-8.79(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-fluoro-4-pyridin-3-yloxyphenyl)-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]prop-2-enamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CN2CCC(CC2)NC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations