Geometry & MOs
Info
ID: |
163094 |
PubChem CID: |
57638805 |
Reduced: |
NRbO3C21H32 (1) |
Stoich.: |
ABC3D21E32 (1) |
Weight, g/mol: |
887.448962 |
ΔHf, kcal/mol: |
-183.31 |
Dipole, Da: |
12.03 |
IP(EA), eV: |
-7.77(0.33) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(2S,4S,6R)-6-[(1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,21'R,24'S)-2-butan-2-yl-21',24'-dihydroxy-3,11',13',22'-tetramethyl-2'-oxospiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-12'-yl]oxy-4-methoxy-2-methyloxan-3-yl] N,N-bis(prop-2-enyl)sulfamate