Geometry & MOs

Info

ID:

47333

PubChem CID:

10531647

Reduced:

SSiO7C31H56 (1)

Stoich.:

ABC7D31E56 (1)

Weight, g/mol:

601.13252

ΔHf, kcal/mol:

-393.98

Dipole, Da:

2.19

IP(EA), eV:

 -8.9(0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(2S,3R,4R,5S,6S)-6-(iodomethyl)-2,4,5-tris(phenylmethoxy)oxan-3-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@]2(CC[C@H]3[C@@H]([C@H]([C@@H]4[C@H]([C@@]3([C@H]2[C@H]5[C@@H]1OC(O5)(C)C)C)O4)OS(=O)(=O)C)C)CO[Si](C(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations