Geometry & MOs
Info
ID: |
127887 |
PubChem CID: |
51021385 |
Reduced: |
NOC8H13 (1) |
Stoich.: |
ABC8D13 (1) |
Weight, g/mol: |
573.293782 |
ΔHf, kcal/mol: |
-9.7 |
Dipole, Da: |
2.25 |
IP(EA), eV: |
-9.07(1.82) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(1S,2R,3S,4R,5R,7R,8S,13R,14R,16S)-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate