Geometry & MOs

Info

ID:

16519

PubChem CID:

472002

Reduced:

SSi2N5O7C25H45 (1)

Stoich.:

AB2C5D7E25F45 (1)

Weight, g/mol:

615.257823

ΔHf, kcal/mol:

-325.26

Dipole, Da:

8.65

IP(EA), eV:

 -8.81(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-[4-amino-9-[tert-butyl(dimethyl)silyl]oxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dioxo-1,7-dioxa-2lambda6-thiaspiro[4.4]non-3-en-8-yl]triazol-4-yl]-(azetidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCC1C2(C(C(O1)N3C(=CN=N3)C(=O)N4CCC4)O[Si](C)(C)C(C)(C)C)C(=CS(=O)(=O)O2)N

DOS

IR

Vibrations