Geometry & MOs

Info

ID:

219833

PubChem CID:

85164943

Reduced:

O11C32H44 (1)

Stoich.:

A11B32C44 (1)

Weight, g/mol:

604.246876

ΔHf, kcal/mol:

-496.18

Dipole, Da:

5.84

IP(EA), eV:

 -9.51(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2,2,2',2'-tetramethylspiro[1,3-dioxolane-4,6'-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran]-7'-yl) 2-(1-diethoxyphosphoryloxyethylidene)-6-trimethylsilylhex-5-ynoate

Drug info:

PubChemData

Smile

CC(=O)OC1CC2C(CCC3(C2(CCC3C4=COC(=O)C=C4)O)C)C5(C1=CC(CC5)OC6C(C(C(C(O6)CO)O)O)O)C

DOS

IR

Vibrations