Geometry & MOs

Info

ID:

386691

PubChem CID:

134982549

Reduced:

OC5H7 (2)

Stoich.:

AB5C7 (2)

Weight, g/mol:

778.432993

ΔHf, kcal/mol:

-51.01

Dipole, Da:

1.7

IP(EA), eV:

-9.47(0.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(E,8R)-4-(benzenesulfonyl)-8-[tert-butyl(dimethyl)silyl]oxy-1-[(4R,6S)-6-[(2Z,4E)-6-[tert-butyl(dimethyl)silyl]oxyhexa-2,4-dienyl]-2,2-dimethyl-1,3-dioxan-4-yl]non-1-en-3-yl] acetate

Drug info:

PubChemData

Smile

COC(=O)[C@H](CC=C)/C=C/C=C

DOS

IR

Vibrations