Geometry & MOs

Info

ID:

391952

PubChem CID:

135011307

Reduced:

OSF2N2C22H26 (1)

Stoich.:

ABC2D2E22F26 (1)

Weight, g/mol:

370.181165

ΔHf, kcal/mol:

-93.15

Dipole, Da:

2.08

IP(EA), eV:

-9.04(-0.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3aR,5S,6S,6aR)-5-[[tert-butyl(dimethyl)silyl]oxy-(furan-2-yl)methyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H](C1(C2=CC=CC=C2)O)C)C(=NCC3=C(C=C(C=C3)F)F)SC

DOS

IR

Vibrations