manganese(4+) ion lithium(1+) ion manganesoylolate dioxidandiide

• ChemBase ID: 303497
• Molecular Formular: LiMn2O4
• Molecular Mass: 180.814698
• Monoisotopic Mass: 180.87175323
• SMILES: [Li+].[O-2].[O-2].[O-][Mn]=O.[Mn+4]
• Canonical SMILES: [O-][Mn]=O.[Li+].[O-2].[O-2].[Mn+4]
• InChI: InChI=1S/Li.2Mn.4O/q+1;;+4;;2*-2;-1
• InChIKey: OLVOKNKYNLWGIZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: manganese(4+) ion lithium(1+) ion manganesoylolate dioxidandiide
• IUPAC Traditional name: manganese(4+) ion lithium(1+) ion permanganate dioxidandiide
• Synonyms: Lithium manganese(III,IV) oxide; 高锰(III,IV)酸锂

Database IDs

• CAS Number: 12057-17-9
• MDL Number: MFCD01114233

CALCULATED PROPERTIES

• Acid pKa: 3.0
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -3.4039774
• LogD (pH = 7.4): -3.598255
• Log P: -1.3376
• Molar Refractivity: 2.8858 cm^3
• Polarizability: 4.7144732 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: -325 Mesh Powder
• Melting Point: >400°C

Safety Information

• TSCA Listed: 是

Product Information

• Purity: 99.5% (metals basis)