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Home > Fluorides > 189217-62-7
189217-62-7 | 4H-1,3,2-Dithiazine, 4,4,5,5,6,6-hexafluorodihydro-, 1,1,3,3-tetraoxide, lithium salt (1:1)
CAS No: 189217-62-7 Catalog No: AG002I2Y MDL No:MFCD06200805
Product Description
Catalog Number:
AG002I2Y
Chemical Name:
4H-1,3,2-Dithiazine, 4,4,5,5,6,6-hexafluorodihydro-, 1,1,3,3-tetraoxide, lithium salt (1:1)
CAS Number:
189217-62-7
Molecular Formula:
C3HF6LiNO4S2
Molecular Weight:
300.1058
MDL Number:
MFCD06200805
IUPAC Name:
lithium;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide
InChI:
InChI=1S/C3F6NO4S2.Li/c4-1(5)2(6,7)15(11,12)10-16(13,14)3(1,8)9;/q-1;+1
InChI Key:
VKQJSJGVEJXINS-UHFFFAOYSA-N
SMILES:
FC1(F)C(F)(F)S(=O)(=O)NS(=O)(=O)C1(F)F.[Li]
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.933g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.086g/mol
Monoisotopic Mass:
298.933g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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