Geometry & MOs

Info

ID:

45176

PubChem CID:

10508757

Reduced:

SiN3O5C40H51 (1)

Stoich.:

AB3C5D40E51 (1)

Weight, g/mol:

682.354349

ΔHf, kcal/mol:

-133.13

Dipole, Da:

4.16

IP(EA), eV:

 -8.65(0.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tri(propan-2-yl)silyl (1R,2S,3R,6Z,10S)-3-[tert-butyl(dimethyl)silyl]oxy-2-ethenyl-10-(methoxymethoxy)-3-methyl-2-phenylsulfanylcycloundec-6-en-4,8-diyne-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CN2[C@@H]([C@@H](CN(N(C2=O)CC3=CC(=CC=C3)OC)CC4=CC=CC=C4)OCOCC[Si](C)(C)C)CC5=CC=CC=C5

DOS

IR

Vibrations