Geometry & MOs

Info

ID:	295957
PubChem CID:	117548628
Reduced:	O3C9H10 (1)
Stoich.:	A3B9C10 (1)
Weight, g/mol:	234.089209
ΔH_f, kcal/mol:	-73.1
Dipole, Da:	3.82
IP(EA), eV:	-9.69(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)oxetan-3-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1(COC1)C2=CC=CO2

DOS

IR

Vibrations