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12163-20-1 molecular structure
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dilutetium(3+) ion trisulfanediuide

ChemBase ID: 111985
Molecular Formular: Lu2S3
Molecular Mass: 446.1286
Monoisotopic Mass: 445.797755
SMILES and InChIs

SMILES:
[SH2-2].[SH2-2].[SH2-2].[Lu+3].[Lu+3]
Canonical SMILES:
[SH2-2].[SH2-2].[SH2-2].[Lu+3].[Lu+3]
InChI:
InChI=1S/2Lu.3S/q2*+3;3*-2
InChIKey:
MSCLAAJLZDTGEX-UHFFFAOYSA-N

Cite this record

CBID:111985 http://www.chembase.cn/molecule-111985.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dilutetium(3+) ion trisulfanediuide
IUPAC Traditional name
dilutetium(3+) trisulfanediuide
Synonyms
LUTETIUM SULFIDE
CAS Number
12163-20-1
PubChem SID
162098203
PubChem CID
166643

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
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Data Source Data ID
PubChem 166643 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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