Molecule

ID:128759

General Information
Structure
MolImage
Molecular Formula
C₃₆H₇₂N₄O₂S₄Sn₄
Molecular Mass
1196.04648
Exact Mass
1200.06258756
Charge
0
InChI
InChI=1S/8C4H9.4CNS.2O.4Sn/c8*1-3-4-2;4*2-1-3;;;;;;/h8*1,3-4H2,2H3;;;;;;;;;;/q;;;;;;;;;;2*-1;;;;;2*+1
InChIKey
PPPXPHOFIOIHRU-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn]12(CCCC)[N](=C=S)[Sn]([O]1[Sn]1([O]2[Sn]([N]1=C=S)(CCCC)(CCCC)N=C=S)(CCCC)CCCC)(CCCC)(CCCC)N=C=S
Isomeric Smiles
[Sn]1([N](=C=S)[Sn]2([O]1[Sn]1([N](=C=S)[Sn]([O]21)(CCCC)(CCCC)N=C=S)(CCCC)CCCC)(CCCC)CCCC)(CCCC)(CCCC)N=C=S
Calculated Properties
JChem
H Acceptors
0
H Donor
0
Molar Refractivity
264.1708
Polar Surface Area
90.32
Rotatable Bonds
26
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
No Data Available
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Bioactivity
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