Geometry & MOs

Info

ID:

17623

PubChem CID:

507959

Reduced:

FO4N7H20C23 (1)

Stoich.:

AB4C7D20E23 (1)

Weight, g/mol:

477.15608

ΔHf, kcal/mol:

-49.05

Dipole, Da:

9.8

IP(EA), eV:

 -9.1(-1.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[7-(5-amino-1,2,4-oxadiazol-3-yl)-4-fluoro-1H-indol-3-yl]-2-[(2R)-2-methyl-4-(pyridine-2-carbonyl)piperazin-1-yl]ethane-1,2-dione

Drug info:

PubChemData

Smile

C[C@@H]1CN(CCN1C(=O)C(=O)C2=CNC3=C(C=CC(=C23)F)C4=NOC(=N4)N)C(=O)C5=CC=CC=N5

DOS

IR

Vibrations