Geometry & MOs

Info

ID:

391778

PubChem CID:

135009459

Reduced:

O7C38H40 (1)

Stoich.:

A7B38C40 (1)

Weight, g/mol:

382.240018

ΔHf, kcal/mol:

-179.37

Dipole, Da:

4.56

IP(EA), eV:

 -9.38(0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl N-[(2R,3R)-1-azido-3-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-N-prop-2-ynylcarbamate

Drug info:

PubChemData

Smile

C[C@]1(C(=O)C[C@@]12[C@@H]([C@H]([C@@H]([C@H](O2)COCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)O

DOS

IR

Vibrations