Geometry & MOs

Info

ID:

436506

PubChem CID:

135204658

Reduced:

F3O3N4H17C18 (1)

Stoich.:

A3B3C4D17E18 (1)

Weight, g/mol:

536.243498

ΔHf, kcal/mol:

-222.58

Dipole, Da:

4.14

IP(EA), eV:

 -8.93(-0.63)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-amino-N-[3'-[2-[1-cyclopropylethyl-[(4-fluorophenyl)methyl]amino]-2-oxoethyl]-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C(=O)O)C(=O)N2CCC3=C(C=CC=C32)C4=C(NN=C4)C(F)(F)F

DOS

IR

Vibrations