Geometry & MOs
Info
ID: |
434218 |
PubChem CID: |
135174451 |
Reduced: |
PN2O5C8H19 (1) |
Stoich.: |
AB2C5D8E19 (1) |
Weight, g/mol: |
729.033651 |
ΔHf, kcal/mol: |
-288.97 |
Dipole, Da: |
3.53 |
IP(EA), eV: |
-9.46(0.62) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-amino-9-[(1R,6R,10R,15R,17R,18R)-9-(7-amino-1,2-dihydrotriazolo[4,5-d]pyrimidin-3-yl)-9,18-difluoro-12-hydroxy-3-oxo-3-sulfanyl-12-sulfanylidene-2,4,7,11,13-pentaoxa-16-thia-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecan-17-yl]-3H-purin-6-one