Geometry & MOs

Info

ID:

176423

PubChem CID:

76047185

Reduced:

SiO5C33H60 (1)

Stoich.:

AB5C33D60 (1)

Weight, g/mol:

453.246598

ΔHf, kcal/mol:

-319.44

Dipole, Da:

3.36

IP(EA), eV:

-8.55(0.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(5-benzyl-2,2-dimethyl-4,6,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-a]pyrrolizin-5-ium-4-yl)methoxy-tert-butyl-dimethylsilane;chloride

Drug info:

PubChemData

Smile

CC1CCC(OC1C(C)C(C(C)COCOC)OCC2=CC=CC=C2)C(C)CO[Si](C(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations