Geometry & MOs

Info

ID:	153362
PubChem CID:	56312548
Reduced:	NF3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	372.184921
ΔH_f, kcal/mol:	-286.98
Dipole, Da:	3.11
IP(EA), eV:	-8.96(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(3-butoxypropyl)-3-(3-fluoro-4-pyridin-3-yloxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)CCC2=CC(=C(C=C2)OCC(F)(F)F)OC

DOS

IR

Vibrations