Geometry & MOs

Info

ID:	428503
PubChem CID:	135167553
Reduced:	O4H12C19 (1)
Stoich.:	A4B12C19 (1)
Weight, g/mol:	290.094294
ΔH_f, kcal/mol:	-77.57
Dipole, Da:	3.72
IP(EA), eV:	-8.75(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-9-methylbenzo[b]xanthen-12-one

Drug info:

PubChemData

Smile

C1COC2=CC3=CC4=C(C=C3C=C2O1)C(=O)C5=CC=CC=C5O4

DOS

IR

Vibrations