Geometry & MOs

Info

ID:

382809

PubChem CID:

134974171

Reduced:

SiO4C20H42 (1)

Stoich.:

AB4C20D42 (1)

Weight, g/mol:

594.152815

ΔHf, kcal/mol:

-284.1

Dipole, Da:

2.38

IP(EA), eV:

-8.6(1.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-[2-[bis(methylsulfanyl)methylideneamino]-3-(10,10-dimethyl-3,3-dioxo-3lambda6-thia-4-azatricyclo[5.2.1.01,5]decan-4-yl)-3-oxopropyl]-6,7-dimethoxychromen-2-one

Drug info:

PubChemData

Smile

CCC[C@H]([C@H]1C(COC(O1)(C)C)OC)O[Si](C(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations