Geometry & MOs

Info

ID:

375935

PubChem CID:

134221931

Reduced:

Cl2F3N3H14C18 (1)

Stoich.:

A2B3C3D14E18 (1)

Weight, g/mol:

547.253415

ΔHf, kcal/mol:

-77.73

Dipole, Da:

6.2

IP(EA), eV:

 -8.83(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-2-[4-(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-1-[(4-fluoro-2-methylphenyl)methyl]-6-methylindol-5-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)Cl)C(/C=C/C2=CC=C(C=C2)N=CN=CN)C(F)(F)F

DOS

IR

Vibrations