Geometry & MOs
Info
ID: |
89748 |
PubChem CID: |
49964274 |
Reduced: |
O2F3H9C10 (1) |
Stoich.: |
A2B3C9D10 (1) |
Weight, g/mol: |
996.208662 |
ΔHf, kcal/mol: |
-216.7 |
Dipole, Da: |
4.74 |
IP(EA), eV: |
-9.98(-0.59) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;titanium(2+);(Z,3R)-4,4,4-trifluoro-1-phenylbut-1-ene-1,3-diol