Geometry & MOs

Info

ID:	21683
PubChem CID:	589524
Reduced:	C31H54 (1)
Stoich.:	A31B54 (1)
Weight, g/mol:	426.422552
ΔH_f, kcal/mol:	-95.99
Dipole, Da:	0.96
IP(EA), eV:	-8.9(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-henicosan-11-yl-1,2,3,4-tetrahydronaphthalene

Drug info:

PubChemData

Smile

CCCCCCCCCCC(CCCCCCCCCC)C1=CC=CC2=C1CCCC2

DOS

IR

Vibrations