bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))

C12H32MoN2O4-6 — CID 139088689

IUPACbis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))
SMILESCC(C)[NH2+]C(C)C.CC(C)[NH2+]C(C)C.[Mo].[O-2].[O-2].[O-2].[O-2]
InChIInChI=1S/2C6H15N.Mo.4O/c2*1-5(2)7-6(3)4;;;;;/h2*5-7H,1-4H3;;;;;/q;;;4*-2/p+2
InChIKeyNPBIBWSOUOONRA-UHFFFAOYSA-P
MW364.34 g/mol
LogP0.26
Rot. Bonds4

About bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))

bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)) (PubChem CID 139088689) has the molecular formula C12H32MoN2O4-6 and a molecular weight of 364.34 g/mol. Its IUPAC name is bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)).

Molecular Properties

Compound Namebis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))
PubChem CID139088689
Molecular FormulaC12H32MoN2O4-6
Molecular Weight364.34 g/mol
Exact Mass366.14
IUPAC Namebis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))
SMILESCC(C)[NH2+]C(C)C.CC(C)[NH2+]C(C)C.[Mo].[O-2].[O-2].[O-2].[O-2]
InChIInChI=1S/2C6H15N.Mo.4O/c2*1-5(2)7-6(3)4;;;;;/h2*5-7H,1-4H3;;;;;/q;;;4*-2/p+2
InChIKeyNPBIBWSOUOONRA-UHFFFAOYSA-P
XLogP0.26
TPSA147.22 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.34
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))?
The IUPAC name of bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)) (CID 139088689) is bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)).
What is the SMILES notation for bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))?
The canonical SMILES for bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)) is CC(C)[NH2+]C(C)C.CC(C)[NH2+]C(C)C.[Mo].[O-2].[O-2].[O-2].[O-2].
What is the InChIKey of bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))?
The InChIKey is NPBIBWSOUOONRA-UHFFFAOYSA-P. The full InChI is InChI=1S/2C6H15N.Mo.4O/c2*1-5(2)7-6(3)4;;;;;/h2*5-7H,1-4H3;;;;;/q;;;4*-2/p+2.
What are the key properties of bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-))?
bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)) has a molecular weight of 364.34 g/mol, XLogP of 0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(di(propan-2-yl)azanium);molybdenum;tetrakis(oxygen(2-)) is sourced from PubChem (CID 139088689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).