Geometry & MOs

Info

ID:

180862

PubChem CID:

76696596

Reduced:

ClFSN3O4C25H25 (1)

Stoich.:

ABCD3E4F25G25 (1)

Weight, g/mol:

560.238333

ΔHf, kcal/mol:

-153.17

Dipole, Da:

4.02

IP(EA), eV:

 -9.34(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethyl 2-[1-[2,3-dihydroxy-4-oxo-4-[1-(4-pyrazol-1-ylphenyl)ethylamino]butanoyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine-8-carboxylate

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C(C(C(=O)NCC2=CC(=CS2)CC3=CN=C(C=C3)Cl)O)O)C4=CC=C(C=C4)F

DOS

IR

Vibrations