Synonyms
MFCD29037183;Trifluoromethylsulfonatotricarbonyl(2,2'-bipyridine)rhenium(I);97170-94-0;
IUPAC Name
carbon monoxide;2-pyridin-2-ylpyridine;rhenium;trifluoromethanesulfonate;
Molecular Weight
575.488g/mol
Molecular Formula
C14H8F3N2O6ReS-;
Canonical SMILES
[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=NC(=C1)C2=CC=CC=N2.C(F)(F)(F)S(=O)(=O)[O-].[Re];
InChI
InChI=1S/C10H8N2.CHF3O3S.3CO.Re/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;2-1(3,4)8(5,6)7;3*1-2;/h1-8H;(H,5,6,7);;;;/p-1;
InChI Key
KIIDDEJBNRQPDQ-UHFFFAOYSA-M;
Complexity
503
Covalently-Bonded Unit Count
6
Exact Mass
575.961g/mol
Formal Charge
-1
H-Bond Acceptor
11
Heavy Atom Count
27
Monoisotopic Mass
575.961g/mol
Rotatable Bond Count
1
Topological Polar Surface Area
94.4A^2
