Alternative Energy / Alfa Chemistry

FK 209 Co(III) TFSI salt

Catalog Number
ACM1447938615-2
CAS
1447938-61-5
Synonyms
Tris[4-(1,1-dimethylethyl)-2-(1H-pyrazol-1-yl)pyridine]cobalt salt with 1,1,1-trifluoro-N-
Molecular Weight
1503.16
Molecular Formula
C42H45CoN12O12S6F18

Product Information

Canonical SMILES
CC(C)(C)C1=CC(=NC=C1)N2C=CC=N2.CC(C)(C)C1=CC(=NC=C1)N2C=CC=N2.CC(C)(C)C1=CC(=NC=C1)N2C=CC=N2.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[Co+3]
InChI
InChI=1S/3C12H15N3.3C2F6NO4S2.Co/c3*1-12(2,3)10-5-7-13-11(9-10)15-8-4-6-14-15;3*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/h3*4-9H,1-3H3;;;;/q;;;3*-1;+3
InChI Key
CLFSUXDTZJJJOK-UHFFFAOYSA-N
Appearance
Orange powder
Complexity
1120
Heavy Atom Count
91
Hydrogen Bond Acceptor Count
39
Hydrogen Bond Donor Count
0
Rotatable Bond Count
9
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