Geometry & MOs

Info

ID:

436554

PubChem CID:

135205301

Reduced:

FN4O4C30H35 (1)

Stoich.:

AB4C4D30E35 (1)

Weight, g/mol:

534.264234

ΔHf, kcal/mol:

-143.07

Dipole, Da:

3.38

IP(EA), eV:

 -8.69(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[6-[(1-aminocyclopropyl)methylamino]-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-(1-cyclopropylethyl)-N-[2-(4-fluorophenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C1CC1)N(CCC2=CC=C(C=C2)F)C(=O)CN3C(=O)C4(CCC5=C4C=CC(=C5)NCC6(CC6)N)OC3=O

DOS

IR

Vibrations