Geometry & MOs

Info

ID:	7984
PubChem CID:	74565
Reduced:	O5H10C12 (1)
Stoich.:	A5B10C12 (1)
Weight, g/mol:	234.052823
ΔH_f, kcal/mol:	-176.15
Dipole, Da:	2.43
IP(EA), eV:	-9.69(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-hydroxy-4-oxochromene-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC2=CC=CC=C2C1=O)O

DOS

IR

Vibrations