cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)

C11H23HfN3 — CID 87349857

IUPACcyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)
SMILESC[N-]C.C[N-]C.C[N-]C.[C-]1=CC=CC1.[Hf+4]
InChIInChI=1S/C5H5.3C2H6N.Hf/c1-2-4-5-3-1;3*1-3-2;/h1-3H,4H2;3*1-2H3;/q4*-1;+4
InChIKeyMNSIRJVSCHJDCI-UHFFFAOYSA-N
MW375.82 g/mol
LogP3.16
Rot. Bonds

About cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)

cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+) (PubChem CID 87349857) has the molecular formula C11H23HfN3 and a molecular weight of 375.82 g/mol. Its IUPAC name is cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+).

Molecular Properties

Compound Namecyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)
PubChem CID87349857
Molecular FormulaC11H23HfN3
Molecular Weight375.82 g/mol
Exact Mass377.14
IUPAC Namecyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)
SMILESC[N-]C.C[N-]C.C[N-]C.[C-]1=CC=CC1.[Hf+4]
InChIInChI=1S/C5H5.3C2H6N.Hf/c1-2-4-5-3-1;3*1-3-2;/h1-3H,4H2;3*1-2H3;/q4*-1;+4
InChIKeyMNSIRJVSCHJDCI-UHFFFAOYSA-N
XLogP3.16
TPSA42.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.82
LogP ≤ 53.16
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(cyclopentadienyl)bis(dimethylamino)titanium
CID 21946355
CID 134889008
CID 134889008
CID 135046880
CID 135046880
N-[cyclopenta-2,4-dien-1-yl(dimethylamino)boranyl]-N-methylmethanamine
CID 15247421
N-[cyclopenta-1,4-dien-1-yl(dimethylamino)boranyl]-N-methylmethanamine
CID 134888025
N-[cyclopenta-1,3-dien-1-yl(dimethylamino)boranyl]-N-methylmethanamine
CID 134888131
cyclopenta-1,3-dien-1-yl(diethyl)borane;N,N-dimethylmethanamine
CID 135048996
Cyclopenta-1,3-diene;bis(dimethylazanide);titanium(3+)
CID 17922065
Carbanide;cyclopenta-1,3-diene;tris(dimethylazanide);zirconium(3+)
CID 18428881
Cyclopenta-1,3-diene;bis(diethylazanide);vanadium
CID 18781806
Cyclopenta-1,3-diene;tris(diethylazanide);hafnium(4+)
CID 18785001
Buta-1,3-diene;carbanide;cyclopenta-1,3-diene;bis(dimethylazanide);titanium(4+)
CID 19035402

Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)?
The IUPAC name of cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+) (CID 87349857) is cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+).
What is the SMILES notation for cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)?
The canonical SMILES for cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+) is C[N-]C.C[N-]C.C[N-]C.[C-]1=CC=CC1.[Hf+4].
What is the InChIKey of cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)?
The InChIKey is MNSIRJVSCHJDCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.3C2H6N.Hf/c1-2-4-5-3-1;3*1-3-2;/h1-3H,4H2;3*1-2H3;/q4*-1;+4.
What are the key properties of cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+)?
cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+) has a molecular weight of 375.82 g/mol, XLogP of 3.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene;tris(dimethylazanide);hafnium(4+) is sourced from PubChem (CID 87349857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).