Geometry & MOs

Info

ID:

220113

PubChem CID:

85165257

Reduced:

Si3N6O6C28H52 (1)

Stoich.:

A3B6C6D28E52 (1)

Weight, g/mol:

653.244857

ΔHf, kcal/mol:

-376.74

Dipole, Da:

9.39

IP(EA), eV:

 -8.95(-1.03)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 4-acetyloxy-2-diethoxyphosphanyloxy-5-(pentanoylamino)-6-(1,2,3-triacetyloxypropyl)oxane-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)[Si]1(OCC2C(C(C(O2)N3C=NC4C3=NC(=NC4=O)N=CN(C)C)O[Si](C)(C)C)O[Si](O1)(C(C)C)C(C)C)C(C)C

DOS

IR

Vibrations