Geometry & MOs
Info
ID: |
180349 |
PubChem CID: |
76618885 |
Reduced: |
F3O3N6C26H31 (1) |
Stoich.: |
A3B3C6D26E31 (1) |
Weight, g/mol: |
919.44046 |
ΔHf, kcal/mol: |
-206.41 |
Dipole, Da: |
6.87 |
IP(EA), eV: |
-8.82(-0.88) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[3,9-bis(carboxymethyl)-13-[3-[5-(4,8,11-trimethyl-1,4,8,11-tetrazacyclotetradec-1-yl)pentanoylamino]propyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(14),11(15),12-trien-6-yl]acetic acid;gadolinium