carbanide;methanone;bis(molybdenum(4+))

C8H12Mo2O6 — CID 58560052

IUPACcarbanide;methanone;bis(molybdenum(4+))
SMILES[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH3-].[CH3-].[Mo+4].[Mo+4]
InChIInChI=1S/6CHO.2CH3.2Mo/c6*1-2;;;;/h6*1H;2*1H3;;/q8*-1;2*+4
InChIKeyURQZZMOLQLINPB-UHFFFAOYSA-N
MW396.06 g/mol
LogP-0.75
Rot. Bonds

About carbanide;methanone;bis(molybdenum(4+))

carbanide;methanone;bis(molybdenum(4+)) (PubChem CID 58560052) has the molecular formula C8H12Mo2O6 and a molecular weight of 396.06 g/mol. Its IUPAC name is carbanide;methanone;bis(molybdenum(4+)).

Molecular Properties

Compound Namecarbanide;methanone;bis(molybdenum(4+))
PubChem CID58560052
Molecular FormulaC8H12Mo2O6
Molecular Weight396.06 g/mol
Exact Mass399.87
IUPAC Namecarbanide;methanone;bis(molybdenum(4+))
SMILES[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH3-].[CH3-].[Mo+4].[Mo+4]
InChIInChI=1S/6CHO.2CH3.2Mo/c6*1-2;;;;/h6*1H;2*1H3;;/q8*-1;2*+4
InChIKeyURQZZMOLQLINPB-UHFFFAOYSA-N
XLogP-0.75
TPSA102.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.06
LogP ≤ 5-0.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;methanone;bis(molybdenum(4+))?
The IUPAC name of carbanide;methanone;bis(molybdenum(4+)) (CID 58560052) is carbanide;methanone;bis(molybdenum(4+)).
What is the SMILES notation for carbanide;methanone;bis(molybdenum(4+))?
The canonical SMILES for carbanide;methanone;bis(molybdenum(4+)) is [CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH3-].[CH3-].[Mo+4].[Mo+4].
What is the InChIKey of carbanide;methanone;bis(molybdenum(4+))?
The InChIKey is URQZZMOLQLINPB-UHFFFAOYSA-N. The full InChI is InChI=1S/6CHO.2CH3.2Mo/c6*1-2;;;;/h6*1H;2*1H3;;/q8*-1;2*+4.
What are the key properties of carbanide;methanone;bis(molybdenum(4+))?
carbanide;methanone;bis(molybdenum(4+)) has a molecular weight of 396.06 g/mol, XLogP of -0.75, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;methanone;bis(molybdenum(4+)) is sourced from PubChem (CID 58560052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).