Geometry & MOs

Info

ID:

170539

PubChem CID:

75249089

Reduced:

FN3O3C25H26 (1)

Stoich.:

AB3C3D25E26 (1)

Weight, g/mol:

675.21679

ΔHf, kcal/mol:

-129.78

Dipole, Da:

5.64

IP(EA), eV:

 -8.9(0.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-benzyl-1-(4-methylphenyl)-1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-piperidine]-2',4,6-trione;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C)C4(N2)CCCN(C4=O)CC5=CC=C(C=C5)F

DOS

IR

Vibrations