Geometry & MOs
Info
ID: |
80132 |
PubChem CID: |
49833167 |
Reduced: |
S2N3O4C21H21 (1) |
Stoich.: |
A2B3C4D21E21 (1) |
Weight, g/mol: |
810.35538 |
ΔHf, kcal/mol: |
-51.09 |
Dipole, Da: |
6.6 |
IP(EA), eV: |
-9.07(-0.99) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1S,4S,5R,8S,9R,10R,12R,13R)-10-[[1-(3-bromopropyl)-6-[[(1S,4S,5R,8S,9R,10R,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]methyl]-2,8,9-trioxabicyclo[3.3.1]nonan-4-yl]methyl]-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecane