Geometry & MOs

Info

ID:	154641
PubChem CID:	56314126
Reduced:	FSN3O4C20H24 (1)
Stoich.:	ABC3D4E20F24 (1)
Weight, g/mol:	417.04471
ΔH_f, kcal/mol:	-146.31
Dipole, Da:	6.42
IP(EA), eV:	-9.1(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(4-amino-3,5-dichlorophenyl)-3-(3-fluoro-4-pyridin-3-yloxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CCN(CCCNC(=O)/C=C/C1=CC(=C(C=C1)OC2=CN=CC=C2)F)S(=O)(=O)C

DOS

IR

Vibrations