dichloro(diisothiocyanato)stannane

C2Cl2N2S2Sn — CID 16684794

IUPACdichloro(diisothiocyanato)stannane
SMILESS=C=N[Sn](Cl)(Cl)N=C=S
InChIInChI=1S/2CNS.2ClH.Sn/c2*2-1-3;;;/h;;2*1H;/q2*-1;;;+4/p-2
InChIKeyGWCVEICSORZEOU-UHFFFAOYSA-L
MW305.79 g/mol
LogP2.11
Rot. Bonds2

About dichloro(diisothiocyanato)stannane

dichloro(diisothiocyanato)stannane (PubChem CID 16684794) has the molecular formula C2Cl2N2S2Sn and a molecular weight of 305.79 g/mol. Its IUPAC name is dichloro(diisothiocyanato)stannane.

Molecular Properties

Compound Namedichloro(diisothiocyanato)stannane
PubChem CID16684794
Molecular FormulaC2Cl2N2S2Sn
Molecular Weight305.79 g/mol
Exact Mass305.79
IUPAC Namedichloro(diisothiocyanato)stannane
SMILESS=C=N[Sn](Cl)(Cl)N=C=S
InChIInChI=1S/2CNS.2ClH.Sn/c2*2-1-3;;;/h;;2*1H;/q2*-1;;;+4/p-2
InChIKeyGWCVEICSORZEOU-UHFFFAOYSA-L
XLogP2.11
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.79
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichloro(diisothiocyanato)stannane?
The IUPAC name of dichloro(diisothiocyanato)stannane (CID 16684794) is dichloro(diisothiocyanato)stannane.
What is the SMILES notation for dichloro(diisothiocyanato)stannane?
The canonical SMILES for dichloro(diisothiocyanato)stannane is S=C=N[Sn](Cl)(Cl)N=C=S.
What is the InChIKey of dichloro(diisothiocyanato)stannane?
The InChIKey is GWCVEICSORZEOU-UHFFFAOYSA-L. The full InChI is InChI=1S/2CNS.2ClH.Sn/c2*2-1-3;;;/h;;2*1H;/q2*-1;;;+4/p-2.
What are the key properties of dichloro(diisothiocyanato)stannane?
dichloro(diisothiocyanato)stannane has a molecular weight of 305.79 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(diisothiocyanato)stannane is sourced from PubChem (CID 16684794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).