carbanide;manganese;methanone

C6H8MnO5-6 — CID 88761601

IUPACcarbanide;manganese;methanone
SMILES[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH3-].[Mn]
InChIInChI=1S/5CHO.CH3.Mn/c5*1-2;;/h5*1H;1H3;/q6*-1;
InChIKeyQBOAPDLSJKDEGN-UHFFFAOYSA-N
MW215.06 g/mol
LogP-0.92
Rot. Bonds

About carbanide;manganese;methanone

carbanide;manganese;methanone (PubChem CID 88761601) has the molecular formula C6H8MnO5-6 and a molecular weight of 215.06 g/mol. Its IUPAC name is carbanide;manganese;methanone.

Molecular Properties

Compound Namecarbanide;manganese;methanone
PubChem CID88761601
Molecular FormulaC6H8MnO5-6
Molecular Weight215.06 g/mol
Exact Mass214.98
IUPAC Namecarbanide;manganese;methanone
SMILES[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH3-].[Mn]
InChIInChI=1S/5CHO.CH3.Mn/c5*1-2;;/h5*1H;1H3;/q6*-1;
InChIKeyQBOAPDLSJKDEGN-UHFFFAOYSA-N
XLogP-0.92
TPSA85.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.06
LogP ≤ 5-0.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Carbanide;manganese;methanone
CID 21015802
Manganese;methanone
CID 57468561
Carbanide;methanone;bis(rhodium(3+))
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Carbanide;methanone;ruthenium(3+);ruthenium(4+)
CID 135084833
CID 162416294
CID 162416294
Formaldehyde;manganese
CID 15199045
Carbanide;methanone;rhenium
CID 15319986
Carbanide;formaldehyde;rhenium
CID 15464817
Manganese;methanolate
CID 15664030
Carbanide;formaldehyde;manganese
CID 15770396
Carbanide;methanone;bis(ruthenium(3+))
CID 58510465
CID 58604669
CID 58604669

Frequently Asked Questions

What is the IUPAC name of carbanide;manganese;methanone?
The IUPAC name of carbanide;manganese;methanone (CID 88761601) is carbanide;manganese;methanone.
What is the SMILES notation for carbanide;manganese;methanone?
The canonical SMILES for carbanide;manganese;methanone is [CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH3-].[Mn].
What is the InChIKey of carbanide;manganese;methanone?
The InChIKey is QBOAPDLSJKDEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/5CHO.CH3.Mn/c5*1-2;;/h5*1H;1H3;/q6*-1;.
What are the key properties of carbanide;manganese;methanone?
carbanide;manganese;methanone has a molecular weight of 215.06 g/mol, XLogP of -0.92, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;manganese;methanone is sourced from PubChem (CID 88761601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).