Geometry & MOs

Info

ID:

327977

PubChem CID:

126691603

Reduced:

FON2C15H17 (1)

Stoich.:

ABC2D15E17 (1)

Weight, g/mol:

677.23244

ΔHf, kcal/mol:

-37.89

Dipole, Da:

5.24

IP(EA), eV:

 -7.98(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 3-[3-[6-(azetidin-1-yl)-2-[[(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]-4-methylpyridin-3-yl]-4-hydroxyphenyl]cyclobutane-1-carboxylate

Drug info:

PubChemData

Smile

CNC1=C2CCCN2C(=C1C=O)C3=CCCC(=C3)F

DOS

IR

Vibrations