Geometry & MOs

Info

ID:	2368
PubChem CID:	7092
Reduced:	OH4C5 (2)
Stoich.:	AB4C5 (2)
Weight, g/mol:	160.052429
ΔH_f, kcal/mol:	-48.58
Dipole, Da:	5.79
IP(EA), eV:	-9.26(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methylchromen-2-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=O)C=C2

DOS

IR

Vibrations