Geometry & MOs

Info

ID:

385532

PubChem CID:

134979336

Reduced:

O2H22C31 (1)

Stoich.:

A2B22C31 (1)

Weight, g/mol:

592.376799

ΔHf, kcal/mol:

111.33

Dipole, Da:

3.37

IP(EA), eV:

 -9.39(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,2R,5R)-2-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-4-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,2,5-trimethylcyclohex-3-ene-1-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC2(C3=CC=CC=C3)/C(=C/C(=O)C4=CC=CC=C4)/C(=O)C5=CC=CC=C5

DOS

IR

Vibrations