tris(cyclopenta-1,3-diene);gold(3+)

C15H15Au — CID 174872260

IUPACtris(cyclopenta-1,3-diene);gold(3+)
SMILES[Au+3].[C-]1=CC=CC1.[C-]1=CC=CC1.[C-]1=CC=CC1
InChIInChI=1S/3C5H5.Au/c3*1-2-4-5-3-1;/h3*1-3H,4H2;/q3*-1;+3
InChIKeyXEHTXLJWZXSMMI-UHFFFAOYSA-N
MW392.25 g/mol
LogP3.91
Rot. Bonds

About tris(cyclopenta-1,3-diene);gold(3+)

tris(cyclopenta-1,3-diene);gold(3+) (PubChem CID 174872260) has the molecular formula C15H15Au and a molecular weight of 392.25 g/mol. Its IUPAC name is tris(cyclopenta-1,3-diene);gold(3+).

Molecular Properties

Compound Nametris(cyclopenta-1,3-diene);gold(3+)
PubChem CID174872260
Molecular FormulaC15H15Au
Molecular Weight392.25 g/mol
Exact Mass392.08
IUPAC Nametris(cyclopenta-1,3-diene);gold(3+)
SMILES[Au+3].[C-]1=CC=CC1.[C-]1=CC=CC1.[C-]1=CC=CC1
InChIInChI=1S/3C5H5.Au/c3*1-2-4-5-3-1;/h3*1-3H,4H2;/q3*-1;+3
InChIKeyXEHTXLJWZXSMMI-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.25
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bis(cyclopenta-1,3-diene);vanadium(2+)
CID 73455747
cyclopenta-1,3-diene;iridium(3+)
CID 19920890
cyclopenta-1,3-diene;zirconium(4+)
CID 22421333
cesium cyclopenta-1,3-diene
CID 18362255
strontium bis(cyclopenta-1,3-diene)
CID 14513562
tris(cyclopenta-1,3-diene);tris(zirconium(2+));trichloride
CID 22239884
cyclopenta-1,3-diene;zirconium;trihydrofluoride
CID 173031456
carbanide;cyclopenta-1,3-diene;osmium(2+)
CID 140608310
cyclopenta-1,3-diene;zirconium(4+);tetrachloride
CID 173166771
bis(cyclopenta-1,3-diene);rhodium(2+);chloride
CID 18934400
carbanide;bis(cyclopenta-1,3-diene);molybdenum(4+)
CID 175390139
bis(cyclopenta-1,3-diene);titanium(2+);hydrochloride
CID 20516591

Frequently Asked Questions

What is the IUPAC name of tris(cyclopenta-1,3-diene);gold(3+)?
The IUPAC name of tris(cyclopenta-1,3-diene);gold(3+) (CID 174872260) is tris(cyclopenta-1,3-diene);gold(3+).
What is the SMILES notation for tris(cyclopenta-1,3-diene);gold(3+)?
The canonical SMILES for tris(cyclopenta-1,3-diene);gold(3+) is [Au+3].[C-]1=CC=CC1.[C-]1=CC=CC1.[C-]1=CC=CC1.
What is the InChIKey of tris(cyclopenta-1,3-diene);gold(3+)?
The InChIKey is XEHTXLJWZXSMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H5.Au/c3*1-2-4-5-3-1;/h3*1-3H,4H2;/q3*-1;+3.
What are the key properties of tris(cyclopenta-1,3-diene);gold(3+)?
tris(cyclopenta-1,3-diene);gold(3+) has a molecular weight of 392.25 g/mol, XLogP of 3.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(cyclopenta-1,3-diene);gold(3+) is sourced from PubChem (CID 174872260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).