Geometry & MOs

Info

ID:	154303
PubChem CID:	56313716
Reduced:	FNOH10C12 (2)
Stoich.:	ABCD10E12 (2)
Weight, g/mol:	427.100205
ΔH_f, kcal/mol:	-70.33
Dipole, Da:	6.29
IP(EA), eV:	-9.3(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)C4=CC=C(C=C4)F

DOS

IR

Vibrations