Geometry & MOs

Info

ID:	232121
PubChem CID:	87575562
Reduced:	PS2O3C16H35 (1)
Stoich.:	AB2C3D16E35 (1)
Weight, g/mol:	570.280381
ΔH_f, kcal/mol:	-240.78
Dipole, Da:	3.07
IP(EA), eV:	-8.76(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-2-[4-[(E)-2-(4-formylphenyl)ethenyl]-5-methoxy-2-(11-sulfanylundecoxy)phenyl]ethenyl]benzaldehyde

Drug info:

PubChemData

Smile

CCCCCCSC(C)OP(O)OC(C)SCCCCCC

DOS

IR

Vibrations