Geometry & MOs
Info
ID: |
388764 |
PubChem CID: |
134990138 |
Reduced: |
O2N3C18H18 (1) |
Stoich.: |
A2B3C18D18 (1) |
Weight, g/mol: |
1343.5878 |
ΔHf, kcal/mol: |
-47.3 |
Dipole, Da: |
4.66 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.305126 |
Charge, e: |
0 |
Chem-info
IUPAC name:
carbanide;cobalt(3+);[5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(1R,2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-id-3-yl]propanoylamino]propan-2-yl] phosphate