Geometry & MOs

Info

ID:

219569

PubChem CID:

85149242

Reduced:

NSiO4C35H49 (1)

Stoich.:

ABC4D35E49 (1)

Weight, g/mol:

576.184291

ΔHf, kcal/mol:

-154.09

Dipole, Da:

13.84

IP(EA), eV:

 -7.94(-1.66)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 4-[2-(4-hydroxyphenyl)ethyl]-1-benzofuran-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)[Si](CC1CC2C1(C(=O)N3C2(OCC3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OC(C)(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations