Geometry & MOs

Info

ID:

386485

PubChem CID:

134981899

Reduced:

Si2O6C51H62 (1)

Stoich.:

A2B6C51D62 (1)

Weight, g/mol:

773.279891

ΔHf, kcal/mol:

-225.17

Dipole, Da:

5.91

IP(EA), eV:

 -9.01(-0.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(4E,6E,8E)-10-(dimethylamino)-5,8-dimethyldeca-4,6,8-trien-3-yl] (2Z,4E,7S)-5-methyl-7-[(3R,5S)-5-(1,3-thiazol-4-yl)-3-[(1,1,1-trichloro-2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]oxyocta-2,4-dienoate

Drug info:

PubChemData

Smile

C[C@@](/C=C/C1CC=CC(=O)O1)([C@@H](C[C@H](/C=C\C=C/C=C/CO[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)O[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C)O)O

DOS

IR

Vibrations