Geometry & MOs
Info
ID: |
442280 |
PubChem CID: |
135250976 |
Reduced: |
NO3C5H7 (2) |
Stoich.: |
AB3C5D7 (2) |
Weight, g/mol: |
1294.406937 |
ΔHf, kcal/mol: |
-216.09 |
Dipole, Da: |
3.97 |
IP(EA), eV: |
-9.92(-2.07) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1S,6S,8R,11S,13R,16S,18R,21S,23S,28R,31S,33S,39R,51R)-5,10,15,20,25,30,35,41-octakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,38,40-hexadecaoxanonacyclo[37.2.2.23,6.28,11.213,16.218,21.223,26.228,31.133,37]hexapentacont-26(47)-ene-36,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol