Geometry & MOs

Info

ID:	377190
PubChem CID:	134223229
Reduced:	O3C10H18 (2)
Stoich.:	A3B10C18 (2)
Weight, g/mol:	182.13068
ΔH_f, kcal/mol:	-323.86
Dipole, Da:	5.28
IP(EA), eV:	-9.2(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,8-dimethyl-3-oxabicyclo[4.3.1]decan-2-one

Drug info:

PubChemData

Smile

CCC(CCOC(=O)COC(=O)C(C(C)(C)C)C(C)(C)C)(CC(=C)O)O

DOS

IR

Vibrations