Structure & Deep Data of Fullerene C60 (C60)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Fullerene C60 molecule contains a total of 90 bond(s). There are 90 non-H bond(s), 90 multiple bond(s), 90 aromatic bond(s), 12 five-membered ring(s), 19 six-membered ring(s), 57 nine-membered ring(s), 27 ten-membered ring(s), 54 eleven-membered ring(s), and 84 twelve-membered ring(s). Images of the chemical structure of Fullerene C60 are given below:

The 2D chemical structure image of Fullerene C60 is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Fullerene C60 are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of Fullerene C60 is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of Fullerene C60. Download structure data file (SDF/MOL) file of this compound.

---

Search Another Chemical Structure

Enter another compound to search for chemical structure:

Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you:

Additional Information for Identifying Fullerene C60 Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of Fullerene C60

  The SMILES string of Fullerene C60 is c12c3c4c5c1c6c7c8c2c9c%10c3c%11c%12c4c%13c%14c5c%15c6c%16c7c%17c%18c8c9c%19c%20c%10c%11c%21c%22c%12c%13c%23c%24c%14c%15c%25c%16c%26c%17c%27c%18c%19c%28c%20c%21c%29c%22c%23c%30c%24c%25c%26c%31c%27c%28c%29c%30%31, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Fullerene C60.

• Structure Data File (SDF/MOL File) of Fullerene C60

  The structure data file (SDF/MOL File) of Fullerene C60 is available for download in the SDF page of Fullerene C60, which provides the information about the atoms, bonds, connectivity and coordinates of Fullerene C60. The Fullerene C60 structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of Fullerene C60

  The molecular formula of Fullerene C60 is available in chemical formula page of Fullerene C60, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of Fullerene C60

  The molecular weight of Fullerene C60 is available in molecular weight page of Fullerene C60, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.

• Other names (synonyms) or registry numbers of Fullerene C60

  The Fullerene C60 compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Fullerene C60 including the various registry numbers, if available:

  • Fullerene carbon soot (contains 5-8wt% C60/C70 and higher fullerenes)
  • I14-100412
  • 3B1-009362
  • W-204191
  • C-58450
  • X4482
  • Fullerene powder, C60, 99.5% 100mg
  • (C\\{60}-I\\{h})[5,6]fullerene
  • NP9U26B839
  • Fullerenes - C60/C70 mixture

  • Fullerene powder, sublimed
  • Fullerene Extract, C60
  • [60-Ih]fullerene
  • 60C
  • Fullerene-C60
  • Fullerene-C??
  • Buckminsterfulleren
  • buckminsterfulereno
  • Fullerite
  • soccerballene

  • (C_{60}-I_{h})[5,6]fullerene
  • MFCD00151408
  • C60 Compound
  • (5,6)Fullerene-C60-Ih
  • Buckminsterfullerene C60
  • Fullerene - C60
  • Carbon C60
  • 131159-39-2
  • Fullerene powder
  • (C60-Ih)[5,6]fullerene

  • [5,6]fullerene-C60-Ih
  • Footballene
  • Fullerene 60
  • 99685-96-8
  • Buckyball
  • [60]fullerene
  • Buckminsterfullerene
  • Fullerene
  • Fullerene C60
  • Fullerene powder, mixed

  • C??

---

Fullerene C60 Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Fullerene C60?
C60
How many atoms and what are the elements included the Fullerene C60 molecule?
60 atom(s) - 60 Carbon atom(s)
How many chemical bonds and what kind of bonds are included the Fullerene C60 structure?
90 bond(s) - 90 non-H bond(s), 90 multiple bond(s), 90 aromatic bond(s), 12 five-membered ring(s), 19 six-membered ring(s), 57 nine-membered ring(s), 27 ten-membered ring(s), 54 eleven-membered ring(s), and 84 twelve-membered ring(s)
What’s the Fullerene C60’s molecular weight?
720.642 g/mol
What’s the SMILES code of Fullerene C60?
c12c3c4c5c1c6c7c8c2c9c%10c3c%11c%12c4c%13c%14c5c%15c6c%16c7c%17c%18c8c9c%19c%20c%10c%11c%21c%22c%12c%13c%23c%24c%14c%15c%25c%16c%26c%17c%27c%18c%19c%28c%20c%21c%29c%22c%23c%30c%24c%25c%26c%31c%27c%28c%29c%30%31
What’s the InChI string of Fullerene C60?
InChI=1S/C60/c1-2-5-6-3(1)8-12-10-4(1)9-11-7(2)17-21-13(5)23-24-14(6)22-18(8)28-20(12)30-26-16(10)15(9)25-29-19(11)27(17)37-41-31(21)33(23)43-44-34(24)32(22)42-38(28)48-40(30)46-36(26)35(25)45-39(29)47(37)55-49(41)51(43)57-52(44)50(42)56(48)59-54(46)53(45)58(55)60(57)59
What’s the InChIKey code of Fullerene C60?
XMWRBQBLMFGWIX-UHFFFAOYSA-N

5246 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).