Geometry & MOs

Info

ID:

47463

PubChem CID:

10532955

Reduced:

Si2O9C38H70 (1)

Stoich.:

A2B9C38D70 (1)

Weight, g/mol:

728.03967

ΔHf, kcal/mol:

-534.61

Dipole, Da:

3.42

IP(EA), eV:

 -8.92(0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-2-[3-iodo-1-[3-iodo-2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]naphthalen-1-yl]naphthalen-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)O[C@@H]1[C@H](O[C@H](O[C@H]1[C@H](C)C[C@@H]2COC(O2)(C)C)C3=CC=C(C=C3)OC)C[C@@H](C[C@@H](C)[C@H](C)OCOCC[Si](C)(C)C)O

DOS

IR

Vibrations