Geometry & MOs

Info

ID:	154171
PubChem CID:	56313574
Reduced:	FN2O3H23C24 (1)
Stoich.:	AB2C3D23E24 (1)
Weight, g/mol:	440.05357
ΔH_f, kcal/mol:	-67.09
Dipole, Da:	5.32
IP(EA), eV:	-8.81(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[(2-bromophenyl)methyl]-3-(3-fluoro-4-pyridin-3-yloxyphenyl)-N-methylprop-2-enamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CN(C)C(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F

DOS

IR

Vibrations