Geometry & MOs

Info

ID:

440562

PubChem CID:

135230559

Reduced:

ClFON3C20H27 (1)

Stoich.:

ABCD3E20F27 (1)

Weight, g/mol:

657.23228

ΔHf, kcal/mol:

-56.86

Dipole, Da:

3.77

IP(EA), eV:

 -8.95(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[1-(3,4-difluorophenyl)-5-[[(4R,5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]carbamoylamino]-4-methylpyrazol-3-yl]-2-methoxy-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1CCCCC1)N2C(=CC(=N2)CNC)OCC3=C(C=C(C=C3)F)Cl

DOS

IR

Vibrations