Cas no 116633-52-4 (Bis(N,N',N''-trimethyl-1,4,7-triazacyclononane)-trioxo-dimanganese (IV) di(hexafluorophosphate)monohydrate)
116633-52-4 structure
Product Name:Bis(N,N',N''-trimethyl-1,4,7-triazacyclononane)-trioxo-dimanganese (IV) di(hexafluorophosphate)monohydrate
CAS No:116633-52-4
MF:C18H48F12Mn2N6O3P2
MW:796.416586875916
CID:5036184
Update Time:2023-08-25
Bis(N,N',N''-trimethyl-1,4,7-triazacyclononane)-trioxo-dimanganese (IV) di(hexafluorophosphate)monohydrate Chemical and Physical Properties
Names and Identifiers
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- Bis(N,N',N''-trimethyl-1,4,7-triazacyclononane)-trioxo-dimanganese (IV) di(hexafluorophosphate)monohydrate
- Manganese(2+), bis(octahydro-1,4,7-trimethyl-1H-1,4,7-triazonine-kappaN1,kappaN4,kappaN7)tri-mu-oxodi-, hexafluorophosphate(1-) (1:2)
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- Inchi： 1S/2C9H21N3.2F6P.2Mn.3H2O/c2*1-10-4-6-11(2)8-9-12(3)7-5-10;2*1-7(2,3,4,5)6;;;;;/h2*4-9H2,1-3H3;;;;;3*1H2/q;;2*-1;;;;;
- InChI Key： CZPFWXJMAXFDTE-UHFFFAOYSA-N
- SMILES： [Mn].[Mn].[P-](F)(F)(F)(F)(F)F.[P-](F)(F)(F)(F)(F)F.O.O.O.N1(C)CCN(C)CCN(C)CC1.N1(C)CCN(C)CCN(C)CC1
Computed Properties
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 23
- Heavy Atom Count: 43
- Rotatable Bond Count: 0
- Complexity: 299
- Topological Polar Surface Area: 22.4
Bis(N,N',N''-trimethyl-1,4,7-triazacyclononane)-trioxo-dimanganese (IV) di(hexafluorophosphate)monohydrate Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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