Geometry & MOs

Info

ID:	5028
PubChem CID:	12475
Reduced:	O3C8H8 (1)
Stoich.:	A3B8C8 (1)
Weight, g/mol:	152.047344
ΔH_f, kcal/mol:	-106.33
Dipole, Da:	6.19
IP(EA), eV:	-10.96(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,6,7-tetrahydro-2-benzofuran-1,3-dione

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C(=O)OC2=O

DOS

IR

Vibrations