Geometry & MOs

Info

ID:

394159

PubChem CID:

135022436

Reduced:

SiO5C21H28 (1)

Stoich.:

AB5C21D28 (1)

Weight, g/mol:

574.277798

ΔHf, kcal/mol:

-230.72

Dipole, Da:

5.12

IP(EA), eV:

-9.22(-1.56)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-4'-yl] (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate

Drug info:

PubChemData

Smile

CC1CC2=C(CO1)C(=O)C3=C(C2=O)C=C(C=C3OC)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations