Geometry & MOs

Info

ID:	24725
PubChem CID:	612771
Reduced:	OC9H15 (2)
Stoich.:	AB9C15 (2)
Weight, g/mol:	278.22458
ΔH_f, kcal/mol:	-140.53
Dipole, Da:	2.27
IP(EA), eV:	-8.91(1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,8,8,12-tetramethyl-2,16-dioxatetracyclo[10.3.1.04,9.04,13]hexadecane

Drug info:

PubChemData

Smile

CC1(CCCC23C1CCC4(C2CCC(O4)(OC3)C)C)C

DOS

IR

Vibrations