Geometry & MOs

Info

ID:

380716

PubChem CID:

134971244

Reduced:

SiO6C50H76 (1)

Stoich.:

AB6C50D76 (1)

Weight, g/mol:

710.465873

ΔHf, kcal/mol:

-315.92

Dipole, Da:

3.88

IP(EA), eV:

 -8.6(0.03)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(E)-2-amino-10-(2-hexyl-5,5-dimethyl-1,3-dioxan-2-yl)-4-hydroxy-3-propan-2-yloxy-2-(trityloxymethyl)dec-6-enenitrile

Drug info:

PubChemData

Smile

CCCCCCC1(OCC(CO1)(C)C)CCC/C=C/CC(C(C(COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O[Si](C)(C)C(C)(C)C)OC(C)C)O

DOS

IR

Vibrations