Geometry & MOs

Info

ID:

164355

PubChem CID:

74387594

Reduced:

O4N7C27H41 (1)

Stoich.:

A4B7C27D41 (1)

Weight, g/mol:

736.199504

ΔHf, kcal/mol:

-83.66

Dipole, Da:

4.07

IP(EA), eV:

 -8.45(-1.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[3,5-bis(trifluoromethyl)phenyl]-3-[[2-[4-fluoro-5-[1-(2-hydroxyacetyl)piperidin-4-yl]-2-methoxyphenyl]-5-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CCCCCCCC(=O)O.C1CC1NC(=O)NC2CNNC2=C3N=C4C=CC(=CC4=N3)CN5CCOCC5

DOS

IR

Vibrations