Geometry & MOs

Info

ID:

437605

PubChem CID:

135226652

Reduced:

O3C10H20 (2)

Stoich.:

A3B10C20 (2)

Weight, g/mol:

743.329454

ΔHf, kcal/mol:

-341.96

Dipole, Da:

4.43

IP(EA), eV:

 -9.99(0.83)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-oxo-2-[(4R)-2-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]-4-[(E)-2-phenylethenyl]azetidin-1-yl]-3-(4-piperidin-1-ylpiperidin-1-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(=O)OCC([C@H](CO)OC[C@H](C)O)O

DOS

IR

Vibrations