Geometry & MOs

Info

ID:	12809
PubChem CID:	145809
Reduced:	O4H6C7 (1)
Stoich.:	A4B6C7 (1)
Weight, g/mol:	154.026609
ΔH_f, kcal/mol:	-123.74
Dipole, Da:	6.76
IP(EA), eV:	-9.62(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-oxofuran-2-ylidene)methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OC=C1C=CC(=O)O1

DOS

IR

Vibrations