Geometry & MOs

Info

ID:

380979

PubChem CID:

134971596

Reduced:

O19H54C68 (1)

Stoich.:

A19B54C68 (1)

Weight, g/mol:

372.212071

ΔHf, kcal/mol:

-572.68

Dipole, Da:

1.86

IP(EA), eV:

 -9.81(-0.7)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S)-6-phenyl-1-[1-tri(propan-2-yl)silyloxyethenyl]-3-oxabicyclo[3.1.0]hexan-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OCC2[C@H](C(C([C@H](O2)O[C@H]3C(C([C@@H](C(O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)OC(=O)C9=CC=CC=C9)OC(=O)C1=CC=CC=C1

DOS

IR

Vibrations