Geometry & MOs

Info

ID:

375812

PubChem CID:

134221802

Reduced:

NO4C29H37 (1)

Stoich.:

AB4C29D37 (1)

Weight, g/mol:

453.251523

ΔHf, kcal/mol:

-186.94

Dipole, Da:

7.55

IP(EA), eV:

 -8.49(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-2-[6-methyl-4-(4-methylphenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2,3-dihydroindol-5-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C(=CC3=C2CCN3C(=O)C4CCCCC4)C)C(C(=O)O)OC(C)(C)C

DOS

IR

Vibrations