Geometry & MOs
Info
ID: |
388913 |
PubChem CID: |
134990584 |
Reduced: |
NO4C20H23 (1) |
Stoich.: |
AB4C20D23 (1) |
Weight, g/mol: |
1091.572367 |
ΔHf, kcal/mol: |
-114.48 |
Dipole, Da: |
2.82 |
IP(EA), eV: |
-8.53(-0.02) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione;(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoic acid