Geometry & MOs

Info

ID:

375980

PubChem CID:

134221979

Reduced:

FN2O5H29C30 (1)

Stoich.:

AB2C5D29E30 (1)

Weight, g/mol:

573.252666

ΔHf, kcal/mol:

-223.45

Dipole, Da:

9.01

IP(EA), eV:

 -8.76(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-2-[1-(2,3-dihydro-1-benzofuran-7-carbonyl)-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=CC2=C(CCN2C(=O)C3=CC=C(C=C3)NC(=O)C)C(=C1CC(=O)O)C4=CC(=C5C(=C4C)CCCO5)F

DOS

IR

Vibrations