Geometry & MOs

Info

ID:

375983

PubChem CID:

134221982

Reduced:

NOCl2F3H20C21 (1)

Stoich.:

ABC2D3E20F21 (1)

Weight, g/mol:

575.24833

ΔHf, kcal/mol:

-193.48

Dipole, Da:

5.21

IP(EA), eV:

 -9.63(-0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)/C=C/C(C2=CC(=CC(=C2)Cl)Cl)C(F)(F)F)C(=O)NC(C)C

DOS

IR

Vibrations