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NSC173914 3-methylpyridine; trichloro-methylstannane,Canonical SMILES:

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摘 要:NSC173914 3-methylpyridine; trichloro-methylstannane,Canonical SMILES: CC1=CN=CC=C1.C[Sn](Cl)(Cl)Cl,InChI: InChI=1/C6H7N.CH3.3ClH.Sn/c1-6-3-2-4-7-5-6;;;;;/h2-5H,,1H3;1H3;3*1H;/q;;;;;+3/p-3/fC6H7N.CH3.3Cl.Sn/h;;3*1h;/q;;3*-1;m/rC6H7N.,CH3Cl3Sn/c1-6-3-
[Synonyms]
NSC173914
[Structure]
NSC173914 3-methylpyridine; trichloro-methylstannane,Canonical SMILES:

[ Properties Computed from Structure]
Molecular Weight333.23 [g/mol]
Molecular FormulaC7H10Cl3NSn
H-Bond Donor0
H-Bond Acceptor1
Rotatable Bond Count0
Exact Mass332.890079
MonoIsotopic Mass332.890079
Topological Polar Surface Area12.9
Heavy Atom Count12
Formal Charge0
Complexity80.5
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count2

[ Descriptors Computed from Structure]
IUPAC Name: 3-methylpyridine; trichloro-methylstannane
Canonical SMILES: CC1=CN=CC=C1.C[Sn](Cl)(Cl)Cl
InChI: InChI=1/C6H7N.CH3.3ClH.Sn/c1-6-3-2-4-7-5-6;;;;;/h2-5H,
1H3;1H3;3*1H;/q;;;;;+3/p-3/fC6H7N.CH3.3Cl.Sn/h;;3*1h;/q;;3*-1;m/rC6H7N.
CH3Cl3Sn/c1-6-3-2-4-7-5-6;1-5(2,3)4/h2-5H,1H3;1H3

 
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