Geometry & MOs

Info

ID:	437009
PubChem CID:	135213712
Reduced:	O4H8C11 (2)
Stoich.:	A4B8C11 (2)
Weight, g/mol:	292.203845
ΔH_f, kcal/mol:	-261.03
Dipole, Da:	7.15
IP(EA), eV:	-9.9(-2.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(9-oxabicyclo[6.1.0]nonan-4-yl)cyclodecane-1,6-dione

Drug info:

PubChemData

Smile

C[C@H]1C(=O)C2=C(C=C(C(=C2O)C3=C(C4=C(C(=CC(=C4)C)O)C(=O)C3=O)O)C)C(=O)O1

DOS

IR

Vibrations