Geometry & MOs

Info

ID:

381451

PubChem CID:

134972195

Reduced:

H5C7 (4)

Stoich.:

A5B7 (4)

Weight, g/mol:

509.245133

ΔHf, kcal/mol:

173.16

Dipole, Da:

0.27

IP(EA), eV:

 -8.02(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(3aS,5R,6R,6aR)-2-benzylsulfanyl-6-[tert-butyl(dimethyl)silyl]oxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-5-yl]methoxy-tert-butyl-dimethylsilane

Drug info:

PubChemData

Smile

CC#CC1=CC=C(C=C1)/C=C/C2=C3C=CC=CC3=C(C4=CC=CC=C42)C#CC

DOS

IR

Vibrations