lithium iodomethanethione

CILiS — CID 175924371

IUPAClithium iodomethanethione
SMILESS=[C-]I.[Li+]
InChIInChI=1S/CIS.Li/c2-1-3;/q-1;+1
InChIKeyZPLMXCOTCHMMMO-UHFFFAOYSA-N
MW177.92 g/mol
LogP-1.74
Rot. Bonds

About lithium iodomethanethione

lithium iodomethanethione (PubChem CID 175924371) has the molecular formula CILiS and a molecular weight of 177.92 g/mol. Its IUPAC name is lithium iodomethanethione.

Molecular Properties

Compound Namelithium iodomethanethione
PubChem CID175924371
Molecular FormulaCILiS
Molecular Weight177.92 g/mol
Exact Mass177.89
IUPAC Namelithium iodomethanethione
SMILESS=[C-]I.[Li+]
InChIInChI=1S/CIS.Li/c2-1-3;/q-1;+1
InChIKeyZPLMXCOTCHMMMO-UHFFFAOYSA-N
XLogP-1.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.92
LogP ≤ 5-1.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

tetraiodotantalum;pentahydrate
CID 175768268
sulfanylmethanethione
CID 54696262
lithium;manganese(2+);dichloride
CID 158226354
sodium hydroxymethanethione
CID 173013164
lithium;ethene;fluoroethene
CID 160989628
erbium-162
CID 131708394
indigane;sulfanylidenegallane
CID 174881992
californium-243
CID 175672572
silver;sulfanylidenegallane
CID 175173743
CID 175731467
CID 175731467
gold-189
CID 175672292
lithium(1+)
CID 21279927

Frequently Asked Questions

What is the IUPAC name of lithium iodomethanethione?
The IUPAC name of lithium iodomethanethione (CID 175924371) is lithium iodomethanethione.
What is the SMILES notation for lithium iodomethanethione?
The canonical SMILES for lithium iodomethanethione is S=[C-]I.[Li+].
What is the InChIKey of lithium iodomethanethione?
The InChIKey is ZPLMXCOTCHMMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/CIS.Li/c2-1-3;/q-1;+1.
What are the key properties of lithium iodomethanethione?
lithium iodomethanethione has a molecular weight of 177.92 g/mol, XLogP of -1.74, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium iodomethanethione is sourced from PubChem (CID 175924371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).