Geometry & MOs

Info

ID:	9640
PubChem CID:	91831
Reduced:	C13H20 (2)
Stoich.:	A13B20 (2)
Weight, g/mol:	352.313001
ΔH_f, kcal/mol:	-40.7
Dipole, Da:	0.69
IP(EA), eV:	-8.68(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hexadecylnaphthalene

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCC1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations