Geometry & MOs

Info

ID:	216370
PubChem CID:	85086117
Reduced:	O3C6H10 (2)
Stoich.:	A3B6C10 (2)
Weight, g/mol:	260.104859
ΔH_f, kcal/mol:	-303.42
Dipole, Da:	3.07
IP(EA), eV:	-10.2(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,8-dimethyl-9,10-dioxatricyclo[6.2.2.02,7]dodeca-2,4,6,11-tetraen-11-yl)propanoic acid

Drug info:

PubChemData

Smile

CC(=O)OC1CC2(CC(C1O)O)COC(O2)(C)C

DOS

IR

Vibrations