Geometry & MOs

Info

ID:	23585
PubChem CID:	604743
Reduced:	OC6H6 (2)
Stoich.:	AB6C6 (2)
Weight, g/mol:	188.08373
ΔH_f, kcal/mol:	-67.76
Dipole, Da:	5.66
IP(EA), eV:	-9.22(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7,8-trimethylchromen-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C2C=CC(=O)OC2=C1C)C

DOS

IR

Vibrations