Geometry & MOs

Info

ID:	19551
PubChem CID:	567521
Reduced:	O4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	238.120509
ΔH_f, kcal/mol:	-118.45
Dipole, Da:	1.63
IP(EA), eV:	-9.39(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[1,3-dioxolane-2,9'-bicyclo[3.3.1]non-6-ene]-3'-yl acetate

Drug info:

PubChemData

Smile

CC(=O)OC1CC2CC=CC(C1)C23OCCO3

DOS

IR

Vibrations