bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium

C7H8Cl3Rh — CID 175706064

IUPACbicyclo[2.2.1]hepta-1,3-diene;trichlororhodium
SMILESC1=C2CCC(=C1)C2.Cl[Rh](Cl)Cl
InChIInChI=1S/C7H8.3ClH.Rh/c1-2-7-4-3-6(1)5-7;;;;/h1-2H,3-5H2;3*1H;/q;;;;+3/p-3
InChIKeyQIELHOOPLIAKEO-UHFFFAOYSA-K
MW301.41 g/mol
LogP4.10
Rot. Bonds

About bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium

bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium (PubChem CID 175706064) has the molecular formula C7H8Cl3Rh and a molecular weight of 301.41 g/mol. Its IUPAC name is bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium.

Molecular Properties

Compound Namebicyclo[2.2.1]hepta-1,3-diene;trichlororhodium
PubChem CID175706064
Molecular FormulaC7H8Cl3Rh
Molecular Weight301.41 g/mol
Exact Mass299.87
IUPAC Namebicyclo[2.2.1]hepta-1,3-diene;trichlororhodium
SMILESC1=C2CCC(=C1)C2.Cl[Rh](Cl)Cl
InChIInChI=1S/C7H8.3ClH.Rh/c1-2-7-4-3-6(1)5-7;;;;/h1-2H,3-5H2;3*1H;/q;;;;+3/p-3
InChIKeyQIELHOOPLIAKEO-UHFFFAOYSA-K
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium?
The IUPAC name of bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium (CID 175706064) is bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium.
What is the SMILES notation for bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium?
The canonical SMILES for bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium is C1=C2CCC(=C1)C2.Cl[Rh](Cl)Cl.
What is the InChIKey of bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium?
The InChIKey is QIELHOOPLIAKEO-UHFFFAOYSA-K. The full InChI is InChI=1S/C7H8.3ClH.Rh/c1-2-7-4-3-6(1)5-7;;;;/h1-2H,3-5H2;3*1H;/q;;;;+3/p-3.
What are the key properties of bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium?
bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium has a molecular weight of 301.41 g/mol, XLogP of 4.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[2.2.1]hepta-1,3-diene;trichlororhodium is sourced from PubChem (CID 175706064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).