Geometry & MOs

Info

ID:

59252

PubChem CID:

24775838

Reduced:

N2O5C28H28 (1)

Stoich.:

A2B5C28D28 (1)

Weight, g/mol:

564.323308

ΔHf, kcal/mol:

-125.3

Dipole, Da:

3.21

IP(EA), eV:

 -8.42(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8,13-dihydroxy-19-(2-hydroxyethyl)-9,9,11,14-tetramethyl-3-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-5-oxa-19-azabicyclo[16.1.0]nonadecane-6,10-dione

Drug info:

PubChemData

Smile

COC1=CC2=C(C=CN=C2C=C1)/C=C/C3CCC4(CC3)CN(C(=O)O4)C5=CC6=C(C=C5)OCCO6

DOS

IR

Vibrations