cyclohepta-1,3,5-triene;molybdenum

C7H8Mo — CID 158138098

IUPACcyclohepta-1,3,5-triene;molybdenum
SMILESC1=CC=CCC=C1.[Mo]
InChIInChI=1S/C7H8.Mo/c1-2-4-6-7-5-3-1;/h1-6H,7H2;
InChIKeyFTPFIZBSJBUBBU-UHFFFAOYSA-N
MW188.08 g/mol
LogP2.06
Rot. Bonds

About cyclohepta-1,3,5-triene;molybdenum

cyclohepta-1,3,5-triene;molybdenum (PubChem CID 158138098) has the molecular formula C7H8Mo and a molecular weight of 188.08 g/mol. Its IUPAC name is cyclohepta-1,3,5-triene;molybdenum.

Molecular Properties

Compound Namecyclohepta-1,3,5-triene;molybdenum
PubChem CID158138098
Molecular FormulaC7H8Mo
Molecular Weight188.08 g/mol
Exact Mass189.97
IUPAC Namecyclohepta-1,3,5-triene;molybdenum
SMILESC1=CC=CCC=C1.[Mo]
InChIInChI=1S/C7H8.Mo/c1-2-4-6-7-5-3-1;/h1-6H,7H2;
InChIKeyFTPFIZBSJBUBBU-UHFFFAOYSA-N
XLogP2.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.08
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cyclohepta-1,3,5-triene;molybdenum?
The IUPAC name of cyclohepta-1,3,5-triene;molybdenum (CID 158138098) is cyclohepta-1,3,5-triene;molybdenum.
What is the SMILES notation for cyclohepta-1,3,5-triene;molybdenum?
The canonical SMILES for cyclohepta-1,3,5-triene;molybdenum is C1=CC=CCC=C1.[Mo].
What is the InChIKey of cyclohepta-1,3,5-triene;molybdenum?
The InChIKey is FTPFIZBSJBUBBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.Mo/c1-2-4-6-7-5-3-1;/h1-6H,7H2;.
What are the key properties of cyclohepta-1,3,5-triene;molybdenum?
cyclohepta-1,3,5-triene;molybdenum has a molecular weight of 188.08 g/mol, XLogP of 2.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohepta-1,3,5-triene;molybdenum is sourced from PubChem (CID 158138098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).