Geometry & MOs

Info

ID:	154718
PubChem CID:	56314230
Reduced:	FN4O4H25C26 (1)
Stoich.:	AB4C4D25E26 (1)
Weight, g/mol:	472.154683
ΔH_f, kcal/mol:	-112.63
Dipole, Da:	3.63
IP(EA), eV:	-8.36(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(OC1)CNC(=O)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations