Geometry & MOs

Info

ID:	393751
PubChem CID:	135021599
Reduced:	O2C21H28 (1)
Stoich.:	A2B21C28 (1)
Weight, g/mol:	261.92971
ΔH_f, kcal/mol:	-66.15
Dipole, Da:	2.6
IP(EA), eV:	-9.27(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

4-oxo-6H-chromen-6-ide-3-carbaldehyde;yttrium

Drug info:

PubChemData

Smile

C/C/1=C\CC/C(=C\CC2=CC(=O)[C@H](C/C(=C\CC1)/C)CC2=O)/C

DOS

IR

Vibrations