Geometry & MOs

Info

ID:

402204

PubChem CID:

135054923

Reduced:

N2F3O3C19H25 (1)

Stoich.:

A2B3C3D19E25 (1)

Weight, g/mol:

672.348231

ΔHf, kcal/mol:

-281.26

Dipole, Da:

2.56

IP(EA), eV:

-9.45(-1.17)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl (3S,3'S,4'S,5S,7R)-4'-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-11-hydroxy-3'-methyl-7-pentylspiro[2,6-dioxatricyclo[7.3.1.05,13]trideca-1(13),9,11-triene-3,2'-oxolane]-12-carboxylate

Drug info:

PubChemData

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C[C@@](CC(=O)OC)(C1CCCCC1)NNC(=O)C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations