Geometry & MOs

Info

ID:	154504
PubChem CID:	56313957
Reduced:	FO3N7H16C22 (1)
Stoich.:	AB3C7D16E22 (1)
Weight, g/mol:	493.11077
ΔH_f, kcal/mol:	52.44
Dipole, Da:	7.02
IP(EA), eV:	-9.58(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)OC2=C(C=C(C=C2)/C=C/C(=O)NNC(=O)C3=CC=C(C=C3)N4C=NN=N4)F

DOS

IR

Vibrations