Geometry & MOs

Info

ID:	20526
PubChem CID:	584452
Reduced:	O3H14C17 (1)
Stoich.:	A3B14C17 (1)
Weight, g/mol:	266.094294
ΔH_f, kcal/mol:	-59.83
Dipole, Da:	2.68
IP(EA), eV:	-8.53(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-7-methylchromen-4-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations