Geometry & MOs

Info

ID:	6924
PubChem CID:	70531
Reduced:	O3C10H10 (1)
Stoich.:	A3B10C10 (1)
Weight, g/mol:	178.062994
ΔH_f, kcal/mol:	-88.07
Dipole, Da:	2.41
IP(EA), eV:	-8.94(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanone

Drug info:

PubChemData

Smile

CC(=O)C1COC2=CC=CC=C2O1

DOS

IR

Vibrations