Geometry & MOs

Info

ID:

320740

PubChem CID:

126663151

Reduced:

F2O3N4C33H34 (1)

Stoich.:

A2B3C4D33E34 (1)

Weight, g/mol:

588.254812

ΔHf, kcal/mol:

-133.43

Dipole, Da:

5.37

IP(EA), eV:

 -8.81(-0.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[[8-[3-[(3R)-3-fluoro-3-methyl-2-oxoindol-1-yl]propyl]-1-(4-fluorophenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-3-yl]methyl]benzoic acid

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2N(C1=O)CCCN3CCC4(CC3)C(=O)N(CN4C5=CC=C(C=C5)F)CC6=CC(=CC=C6)C=O)F

DOS

IR

Vibrations