Geometry & MOs

Info

ID:

222654

PubChem CID:

85307675

Reduced:

N5O13C53H59 (1)

Stoich.:

A5B13C53D59 (1)

Weight, g/mol:

974.460922

ΔHf, kcal/mol:

-359.61

Dipole, Da:

5.13

IP(EA), eV:

 -9.3(-0.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl-[[3-[2-[2-[[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-6-ethoxy-3,6-dihydro-2H-pyran-3-yl]oxy]phenyl]phenoxy]-6-ethoxy-3,6-dihydro-2H-pyran-2-yl]methoxy]-diphenylsilane

Drug info:

PubChemData

Smile

C1CN(C(=O)N(C1=O)COCC2=CC=CC=C2)C3C(C(C(O3)COC4C(C(C(C(O4)CN=[N+]=[N-])O)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCOCC7=CC=CC=C7)OCOCC8=CC=CC=C8

DOS

IR

Vibrations