Geometry & MOs

Info

ID:

312020

PubChem CID:

126601916

Reduced:

NF2O5C33H37 (1)

Stoich.:

AB2C5D33E37 (1)

Weight, g/mol:

565.26398

ΔHf, kcal/mol:

-295.14

Dipole, Da:

6.19

IP(EA), eV:

 -8.68(-0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4,5-bis(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-2,6-dimethylpyridin-3-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CC1=C2CCCOC2=C(C=C1C3=C(N=C(C(=C3C4=CC(=C5C(=C4C)CCCO5)F)[C@@H](C(=O)O)OC(C)(C)C)C)C)F

DOS

IR

Vibrations