Geometry & MOs

Info

ID:	160061
PubChem CID:	57304558
Reduced:	FN3C20H20 (1)
Stoich.:	AB3C20D20 (1)
Weight, g/mol:	346.206343
ΔH_f, kcal/mol:	16.36
Dipole, Da:	3.4
IP(EA), eV:	-8.57(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

docosa-4,7,10,13,16,19-hexaenoyl chloride

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCCNC2=CC(=NC=C2C3=CC=CC=C3F)N

DOS

IR

Vibrations