carbon monoxide;chromium(6+);pyrrolidin-1-ide

C9H8CrNO5+5 — CID 4210612

IUPACcarbon monoxide;chromium(6+);pyrrolidin-1-ide
SMILESC1CC[N-]C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr+6]
InChIInChI=1S/C4H8N.5CO.Cr/c1-2-4-5-3-1;5*1-2;/h1-4H2;;;;;;/q-1;;;;;;+6
InChIKeyLQYOEYMNYDNPDB-UHFFFAOYSA-N
MW262.16 g/mol
LogP0.96
Rot. Bonds

About carbon monoxide;chromium(6+);pyrrolidin-1-ide

carbon monoxide;chromium(6+);pyrrolidin-1-ide (PubChem CID 4210612) has the molecular formula C9H8CrNO5+5 and a molecular weight of 262.16 g/mol. Its IUPAC name is carbon monoxide;chromium(6+);pyrrolidin-1-ide.

Molecular Properties

Compound Namecarbon monoxide;chromium(6+);pyrrolidin-1-ide
PubChem CID4210612
Molecular FormulaC9H8CrNO5+5
Molecular Weight262.16 g/mol
Exact Mass261.98
IUPAC Namecarbon monoxide;chromium(6+);pyrrolidin-1-ide
SMILESC1CC[N-]C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr+6]
InChIInChI=1S/C4H8N.5CO.Cr/c1-2-4-5-3-1;5*1-2;/h1-4H2;;;;;;/q-1;;;;;;+6
InChIKeyLQYOEYMNYDNPDB-UHFFFAOYSA-N
XLogP0.96
TPSA113.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.16
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbon monoxide;chromium(6+);pyrrolidin-1-ide?
The IUPAC name of carbon monoxide;chromium(6+);pyrrolidin-1-ide (CID 4210612) is carbon monoxide;chromium(6+);pyrrolidin-1-ide.
What is the SMILES notation for carbon monoxide;chromium(6+);pyrrolidin-1-ide?
The canonical SMILES for carbon monoxide;chromium(6+);pyrrolidin-1-ide is C1CC[N-]C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr+6].
What is the InChIKey of carbon monoxide;chromium(6+);pyrrolidin-1-ide?
The InChIKey is LQYOEYMNYDNPDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N.5CO.Cr/c1-2-4-5-3-1;5*1-2;/h1-4H2;;;;;;/q-1;;;;;;+6.
What are the key properties of carbon monoxide;chromium(6+);pyrrolidin-1-ide?
carbon monoxide;chromium(6+);pyrrolidin-1-ide has a molecular weight of 262.16 g/mol, XLogP of 0.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;chromium(6+);pyrrolidin-1-ide is sourced from PubChem (CID 4210612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).