chromium(2+);bis(cyclopenta-1,3-diene)

C10H10Cr — CID 15811016

IUPACchromium(2+);bis(cyclopenta-1,3-diene)
SMILES[Cr+2].c1cc[cH-]c1.c1cc[cH-]c1
InChIInChI=1S/2C5H5.Cr/c2*1-2-4-5-3-1;/h2*1-5H;/q2*-1;+2
InChIKeyTYYBBNOTQFVVKN-UHFFFAOYSA-N
MW182.19 g/mol
LogP2.81
Rot. Bonds

About chromium(2+);bis(cyclopenta-1,3-diene)

chromium(2+);bis(cyclopenta-1,3-diene) (PubChem CID 15811016) has the molecular formula C10H10Cr and a molecular weight of 182.19 g/mol. Its IUPAC name is chromium(2+);bis(cyclopenta-1,3-diene).

Molecular Properties

Compound Namechromium(2+);bis(cyclopenta-1,3-diene)
PubChem CID15811016
Molecular FormulaC10H10Cr
Molecular Weight182.19 g/mol
Exact Mass182.02
IUPAC Namechromium(2+);bis(cyclopenta-1,3-diene)
SMILES[Cr+2].c1cc[cH-]c1.c1cc[cH-]c1
InChIInChI=1S/2C5H5.Cr/c2*1-2-4-5-3-1;/h2*1-5H;/q2*-1;+2
InChIKeyTYYBBNOTQFVVKN-UHFFFAOYSA-N
XLogP2.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 52.81
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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Frequently Asked Questions

What is the IUPAC name of chromium(2+);bis(cyclopenta-1,3-diene)?
The IUPAC name of chromium(2+);bis(cyclopenta-1,3-diene) (CID 15811016) is chromium(2+);bis(cyclopenta-1,3-diene).
What is the SMILES notation for chromium(2+);bis(cyclopenta-1,3-diene)?
The canonical SMILES for chromium(2+);bis(cyclopenta-1,3-diene) is [Cr+2].c1cc[cH-]c1.c1cc[cH-]c1.
What is the InChIKey of chromium(2+);bis(cyclopenta-1,3-diene)?
The InChIKey is TYYBBNOTQFVVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H5.Cr/c2*1-2-4-5-3-1;/h2*1-5H;/q2*-1;+2.
What are the key properties of chromium(2+);bis(cyclopenta-1,3-diene)?
chromium(2+);bis(cyclopenta-1,3-diene) has a molecular weight of 182.19 g/mol, XLogP of 2.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chromium(2+);bis(cyclopenta-1,3-diene) is sourced from PubChem (CID 15811016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).