Geometry & MOs

Info

ID:	24387
PubChem CID:	609819
Reduced:	O4H10C11 (1)
Stoich.:	A4B10C11 (1)
Weight, g/mol:	206.057909
ΔH_f, kcal/mol:	-131.65
Dipole, Da:	3.04
IP(EA), eV:	-9.27(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(hydroxymethyl)-7-methoxychromen-2-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=CC(=O)O2)CO

DOS

IR

Vibrations