Geometry & MOs

Info

ID:	398076
PubChem CID:	135031631
Reduced:	FO2H15C18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	314.131823
ΔH_f, kcal/mol:	-78.42
Dipole, Da:	1.67
IP(EA), eV:	-9.21(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-8-methoxy-9-(2-methylbut-3-en-2-yl)xanthen-9-ol

Drug info:

PubChemData

Smile

CC(=CCC1=C2C(=CC(=C1)F)OC3=CC=CC=C3C2=O)C

DOS

IR

Vibrations