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162106383 molecular structure
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molybdenum(6+) ion trisulfanediuide

ChemBase ID: 110536
Molecular Formular: MoS3
Molecular Mass: 192.155
Monoisotopic Mass: 193.821621
SMILES and InChIs

SMILES:
[SH2-2].[SH2-2].[SH2-2].[Mo+6]
Canonical SMILES:
[SH2-2].[SH2-2].[SH2-2].[Mo+6]
InChI:
InChI=1S/Mo.3S/q+6;3*-2
InChIKey:
XYBZEHZFCCFXPF-UHFFFAOYSA-N

Cite this record

CBID:110536 http://www.chembase.cn/molecule-110536.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
molybdenum(6+) ion trisulfanediuide
IUPAC Traditional name
molybdenum(6+) trisulfanediuide
Synonyms
MOLYBDENUM TRISULFIDE
PubChem SID
162106383
PubChem CID
10130318

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05215446 external link Add to cart Please log in.
Data Source Data ID
PubChem 10130318 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.69215196  LogD (pH = 7.4) -0.85428166 
Log P -0.6895  Molar Refractivity 7.3558 cm3
Polarizability 2.9659069 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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