Geometry & MOs

Info

ID:	19843
PubChem CID:	573995
Reduced:	O2C23H44 (1)
Stoich.:	A2B23C44 (1)
Weight, g/mol:	352.334131
ΔH_f, kcal/mol:	-187.28
Dipole, Da:	1.84
IP(EA), eV:	-10.35(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexadecan-4-yl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(CCC)OC(=O)C1CCCCC1

DOS

IR

Vibrations