Geometry & MOs

Info

ID:	312260
PubChem CID:	126603927
Reduced:	O2C11H18 (1)
Stoich.:	A2B11C18 (1)
Weight, g/mol:	596.155906
ΔH_f, kcal/mol:	-118.4
Dipole, Da:	4.5
IP(EA), eV:	-10.65(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-fluoro-5-[[5-(4-fluorophenyl)-2-hydroxy-6-(4-hydroxyphenyl)-1,2-dihydropyridin-3-yl]oxy]phenyl]-6-(3-fluorophenyl)-3-hydroxy-1H-pyridin-2-one

Drug info:

PubChemData

Smile

C1CCC(C1)C2CCC[C@H]2C(=O)O

DOS

IR

Vibrations