CID 18723958

C4H11N3SiW4- — CID 18723958

IUPAC
SMILESC[N-]C[N-]C.[NH-]C[Si].[W+2].[W].[W].[W]
InChIInChI=1S/C3H8N2.CH3NSi.4W/c1-4-3-5-2;2-1-3;;;;/h3H2,1-2H3;2H,1H2;;;;/q-2;-1;;;;+2
InChIKeyFMPBLOQZSBPWPM-UHFFFAOYSA-N
MW864.60 g/mol
LogP1.11
Rot. Bonds2

About CID 18723958

CID 18723958 (PubChem CID 18723958) has the molecular formula C4H11N3SiW4- and a molecular weight of 864.60 g/mol.

Molecular Properties

Compound NameCID 18723958
PubChem CID18723958
Molecular FormulaC4H11N3SiW4-
Molecular Weight864.60 g/mol
Exact Mass864.88
IUPAC Name
SMILESC[N-]C[N-]C.[NH-]C[Si].[W+2].[W].[W].[W]
InChIInChI=1S/C3H8N2.CH3NSi.4W/c1-4-3-5-2;2-1-3;;;;/h3H2,1-2H3;2H,1H2;;;;/q-2;-1;;;;+2
InChIKeyFMPBLOQZSBPWPM-UHFFFAOYSA-N
XLogP1.11
TPSA52.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500864.60
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 18723958?
The IUPAC name of CID 18723958 (CID 18723958) is not available.
What is the SMILES notation for CID 18723958?
The canonical SMILES for CID 18723958 is C[N-]C[N-]C.[NH-]C[Si].[W+2].[W].[W].[W].
What is the InChIKey of CID 18723958?
The InChIKey is FMPBLOQZSBPWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2.CH3NSi.4W/c1-4-3-5-2;2-1-3;;;;/h3H2,1-2H3;2H,1H2;;;;/q-2;-1;;;;+2.
What are the key properties of CID 18723958?
CID 18723958 has a molecular weight of 864.60 g/mol, XLogP of 1.11, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18723958 is sourced from PubChem (CID 18723958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).