Geometry & MOs

Info

ID:	406904
PubChem CID:	135078885
Reduced:	FNH12C15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	292.167459
ΔH_f, kcal/mol:	44.8
Dipole, Da:	0.68
IP(EA), eV:	-8.53(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-(2-cyclopropylideneethyl)-2-[(2E)-penta-2,4-dienyl]propanedioate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC#CC2=CC=C(C=C2)F)N

DOS

IR

Vibrations