Geometry & MOs
Info
ID: |
232106 |
PubChem CID: |
87575537 |
Reduced: |
BrO2C9H11 (1) |
Stoich.: |
AB2C9D11 (1) |
Weight, g/mol: |
761.178228 |
ΔHf, kcal/mol: |
-67.48 |
Dipole, Da: |
5.39 |
IP(EA), eV: |
-10.24(-0.86) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
sodium;2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one;[(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphate