Geometry & MOs

Info

ID:

375826

PubChem CID:

134221817

Reduced:

NO9C38H59 (1)

Stoich.:

AB9C38D59 (1)

Weight, g/mol:

478.283158

ΔHf, kcal/mol:

-444.26

Dipole, Da:

12.78

IP(EA), eV:

 -9.44(0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1C2CC[C@]3(C4CC[C@]5(CC[C@@H](CC5C4=CC(=O)C3C2(CCC1=O)C)C(=O)NCCOCCOCCOCCOCCC(=O)O)C)C

DOS

IR

Vibrations