indigane;triiodoindigane

H3I3In2 — CID 175311893

IUPACindigane;triiodoindigane
SMILESI[In](I)I.[InH3]
InChIInChI=1S/3HI.2In.3H/h3*1H;;;;;/q;;;;+3;;;/p-3
InChIKeyIAJBJSGRTWENGY-UHFFFAOYSA-K
MW613.37 g/mol
LogP1.09
Rot. Bonds

About indigane;triiodoindigane

indigane;triiodoindigane (PubChem CID 175311893) has the molecular formula H3I3In2 and a molecular weight of 613.37 g/mol. Its IUPAC name is indigane;triiodoindigane.

Molecular Properties

Compound Nameindigane;triiodoindigane
PubChem CID175311893
Molecular FormulaH3I3In2
Molecular Weight613.37 g/mol
Exact Mass613.54
IUPAC Nameindigane;triiodoindigane
SMILESI[In](I)I.[InH3]
InChIInChI=1S/3HI.2In.3H/h3*1H;;;;;/q;;;;+3;;;/p-3
InChIKeyIAJBJSGRTWENGY-UHFFFAOYSA-K
XLogP1.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500613.37
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of indigane;triiodoindigane?
The IUPAC name of indigane;triiodoindigane (CID 175311893) is indigane;triiodoindigane.
What is the SMILES notation for indigane;triiodoindigane?
The canonical SMILES for indigane;triiodoindigane is I[In](I)I.[InH3].
What is the InChIKey of indigane;triiodoindigane?
The InChIKey is IAJBJSGRTWENGY-UHFFFAOYSA-K. The full InChI is InChI=1S/3HI.2In.3H/h3*1H;;;;;/q;;;;+3;;;/p-3.
What are the key properties of indigane;triiodoindigane?
indigane;triiodoindigane has a molecular weight of 613.37 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for indigane;triiodoindigane is sourced from PubChem (CID 175311893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).