Geometry & MOs

Info

ID:

406716

PubChem CID:

135078442

Reduced:

O5C11H18 (1)

Stoich.:

A5B11C18 (1)

Weight, g/mol:

944.3434

ΔHf, kcal/mol:

-228.85

Dipole, Da:

2.58

IP(EA), eV:

-10.19(0.3)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

Se-phenyl 2-[(2R,3S,5R,6S)-3-[3-[(2R,4aR,6S,7R,8aS)-7-[tert-butyl(dimethyl)silyl]oxy-2-(4-methoxyphenyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]prop-1-enoxy]-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]ethaneselenoate

Drug info:

PubChemData

Smile

CC(C)OC1C=CC(C(O1)COC(=O)C)O

DOS

IR

Vibrations