Geometry & MOs

Info

ID:

391964

PubChem CID:

135011418

Reduced:

Si3O8C44H84 (1)

Stoich.:

A3B8C44D84 (1)

Weight, g/mol:

622.347883

ΔHf, kcal/mol:

-536.79

Dipole, Da:

4.7

IP(EA), eV:

 -8.6(0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl 2-[[(2S)-2-[[(9R)-10-azido-9-(phenylmethoxycarbonylamino)decanoyl]amino]propanoyl]amino]-3-methylbutanoate

Drug info:

PubChemData

Smile

C[C@H]([C@@H](C[C@@H]1C/C(=C\CO[Si](C(C)C)(C(C)C)C(C)C)/[C@H]([C@](O1)(C(C)(C)COCC2=CC=CC=C2)OC)O)OCOCC[Si](C)(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations