Geometry & MOs

Info

ID:	439230
PubChem CID:	135228997
Reduced:	FON3C18H26 (1)
Stoich.:	ABC3D18E26 (1)
Weight, g/mol:	342.210742
ΔH_f, kcal/mol:	-66.96
Dipole, Da:	4.31
IP(EA), eV:	-8.42(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(E)-1-(ethylideneamino)prop-1-en-2-yl]-6-fluorophenyl]-5-[(Z)-prop-1-enyl]iminoheptan-4-one

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(CC2C3=C(C=CC=C3F)/C(=C/N)/N2N)O

DOS

IR

Vibrations