Geometry & MOs

Info

ID:	428516
PubChem CID:	135167566
Reduced:	O3H14C19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	290.094294
ΔH_f, kcal/mol:	-14.68
Dipole, Da:	1.97
IP(EA), eV:	-8.64(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-8-methylbenzo[b]xanthen-12-one

Drug info:

PubChemData

Smile

CC1=CC2=CC3=C(C=C2C=C1)C(=O)C4=C(O3)C=CC=C4OC

DOS

IR

Vibrations