Geometry & MOs

Info

ID:

375847

PubChem CID:

134221839

Reduced:

FNO3C23H28 (1)

Stoich.:

ABC3D23E28 (1)

Weight, g/mol:

617.220064

ΔHf, kcal/mol:

-165.34

Dipole, Da:

6.6

IP(EA), eV:

 -8.47(-0.21)

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-[3-fluoro-4-(trifluoromethyl)benzoyl]-6-methyl-2,3-dihydroindol-5-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C(=C1)C)C2=C(C(=CC3=C2CCN3C)C)CC(=O)O)F

DOS

IR

Vibrations