Geometry & MOs

Info

ID:	18170
PubChem CID:	538692
Reduced:	O5C16H28 (1)
Stoich.:	A5B16C28 (1)
Weight, g/mol:	300.193674
ΔH_f, kcal/mol:	-257.36
Dipole, Da:	1.27
IP(EA), eV:	-10.04(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,11,11-tetramethyl-6-pentyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane

Drug info:

PubChemData

Smile

CCCCCC12C(C3C(O1)COC(O3)(C)C)OC(O2)(C)C

DOS

IR

Vibrations