carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten

C28H25NO5SiW — CID 602822

IUPACcarbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten
SMILESCCN(CC)C(=[W])[Si](c1ccccc1)(c1ccccc1)c1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C23H25NSi.5CO.W/c1-3-24(4-2)20-25(21-14-8-5-9-15-21,22-16-10-6-11-17-22)23-18-12-7-13-19-23;5*1-2;/h5-19H,3-4H2,1-2H3;;;;;;
InChIKeyKHUTXJDMVJNSLE-UHFFFAOYSA-N
MW667.44 g/mol
LogP2.53
Rot. Bonds7

About carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten

carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten (PubChem CID 602822) has the molecular formula C28H25NO5SiW and a molecular weight of 667.44 g/mol. Its IUPAC name is carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten.

Molecular Properties

Compound Namecarbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten
PubChem CID602822
Molecular FormulaC28H25NO5SiW
Molecular Weight667.44 g/mol
Exact Mass667.10
IUPAC Namecarbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten
SMILESCCN(CC)C(=[W])[Si](c1ccccc1)(c1ccccc1)c1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C23H25NSi.5CO.W/c1-3-24(4-2)20-25(21-14-8-5-9-15-21,22-16-10-6-11-17-22)23-18-12-7-13-19-23;5*1-2;/h5-19H,3-4H2,1-2H3;;;;;;
InChIKeyKHUTXJDMVJNSLE-UHFFFAOYSA-N
XLogP2.53
TPSA102.74 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500667.44
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten?
The IUPAC name of carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten (CID 602822) is carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten.
What is the SMILES notation for carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten?
The canonical SMILES for carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten is CCN(CC)C(=[W])[Si](c1ccccc1)(c1ccccc1)c1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten?
The InChIKey is KHUTXJDMVJNSLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NSi.5CO.W/c1-3-24(4-2)20-25(21-14-8-5-9-15-21,22-16-10-6-11-17-22)23-18-12-7-13-19-23;5*1-2;/h5-19H,3-4H2,1-2H3;;;;;;.
What are the key properties of carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten?
carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten has a molecular weight of 667.44 g/mol, XLogP of 2.53, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[diethylamino(triphenylsilyl)methylidene]tungsten is sourced from PubChem (CID 602822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).