Geometry & MOs

Info

ID:	3838
PubChem CID:	10286
Reduced:	O2H6C9 (1)
Stoich.:	A2B6C9 (1)
Weight, g/mol:	146.036779
ΔH_f, kcal/mol:	-33.06
Dipole, Da:	3.63
IP(EA), eV:	-9.65(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chromen-4-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C=CO2

DOS

IR

Vibrations