Geometry & MOs
Info
ID: |
227541 |
PubChem CID: |
87561955 |
Reduced: |
NF4C11H13 (1) |
Stoich.: |
AB4C11D13 (1) |
Weight, g/mol: |
1271.663766 |
ΔHf, kcal/mol: |
-186.06 |
Dipole, Da: |
3.44 |
IP(EA), eV: |
-9.49(0.11) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
3-[2-[(4R)-4-[(3R,7R,10S,13R,17R)-7-(3,4-dicarboxy-3-hydroxybutanoyl)oxy-10,13-dimethyl-3-[(4R)-4-[(3R,5S,7R,10S,12S,13R,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]oxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]oxyphenoxy]sulfonyloxy-4-(trimethylazaniumyl)butanoate