diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide

H13MoN2OS4+ — CID 173398395

IUPACdiazanium;molybdenum;sulfane;sulfanide;sulfur monoxide
SMILESO=S.S.S.[Mo].[NH4+].[NH4+].[SH-]
InChIInChI=1S/Mo.2H3N.OS.3H2S/c;;;1-2;;;/h;2*1H3;;3*1H2/p+1
InChIKeyUKTJLFMFXJMNTO-UHFFFAOYSA-O
MW281.32 g/mol
LogP0.37
Rot. Bonds

About diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide

diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide (PubChem CID 173398395) has the molecular formula H13MoN2OS4+ and a molecular weight of 281.32 g/mol. Its IUPAC name is diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide.

Molecular Properties

Compound Namediazanium;molybdenum;sulfane;sulfanide;sulfur monoxide
PubChem CID173398395
Molecular FormulaH13MoN2OS4+
Molecular Weight281.32 g/mol
Exact Mass282.90
IUPAC Namediazanium;molybdenum;sulfane;sulfanide;sulfur monoxide
SMILESO=S.S.S.[Mo].[NH4+].[NH4+].[SH-]
InChIInChI=1S/Mo.2H3N.OS.3H2S/c;;;1-2;;;/h;2*1H3;;3*1H2/p+1
InChIKeyUKTJLFMFXJMNTO-UHFFFAOYSA-O
XLogP0.37
TPSA90.07 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide?
The IUPAC name of diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide (CID 173398395) is diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide.
What is the SMILES notation for diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide?
The canonical SMILES for diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide is O=S.S.S.[Mo].[NH4+].[NH4+].[SH-].
What is the InChIKey of diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide?
The InChIKey is UKTJLFMFXJMNTO-UHFFFAOYSA-O. The full InChI is InChI=1S/Mo.2H3N.OS.3H2S/c;;;1-2;;;/h;2*1H3;;3*1H2/p+1.
What are the key properties of diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide?
diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide has a molecular weight of 281.32 g/mol, XLogP of 0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diazanium;molybdenum;sulfane;sulfanide;sulfur monoxide is sourced from PubChem (CID 173398395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).