Geometry & MOs

Info

ID:

432520

PubChem CID:

135172653

Reduced:

O4C17H24 (2)

Stoich.:

A4B17C24 (2)

Weight, g/mol:

480.248504

ΔHf, kcal/mol:

-355.54

Dipole, Da:

3.72

IP(EA), eV:

 -8.79(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-4-propan-2-yl-3-[2-[[(1S)-1-[6-(1-prop-2-enoylpiperidin-4-yl)oxypyridin-3-yl]ethyl]amino]pyrimidin-4-yl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CCCCCC1=CC2=C(C=C1)C=C(C=C2)C3CC(CC(C3)OCCOC(=O)C(C)(C)CO)OCCOC(=O)C(=C)CO

DOS

IR

Vibrations