Geometry & MOs

Info

ID:	151035
PubChem CID:	53790732
Reduced:	O3C25H28 (1)
Stoich.:	A3B25C28 (1)
Weight, g/mol:	465.36068
ΔH_f, kcal/mol:	-94.83
Dipole, Da:	7.17
IP(EA), eV:	-8.74(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-dodec-4-enoxy-2-[4-(5-propoxypentyl)phenyl]pyridine

Drug info:

PubChemData

Smile

C[C@@H]1C=C(C=C(C1C(=O)C2=C(C=C(C=C2CC3=CC(=O)C=C(O3)C)C)C)C)C

DOS

IR

Vibrations