 |
I2I : Summary
Code  |
I2I |
One-letter code |
X |
Molecule name |
molecular iodine |
Systematic names |
|
Formula |
I2 |
Formal charge |
0 |
Molecular weight |
253.809 Da |
SMILES |
| Type |
Program |
Version |
Descriptor |
| SMILES |
ACDLabs |
12.01 |
II |
| SMILES |
CACTVS |
3.385 |
II |
| SMILES |
OpenEye OEToolkits |
1.7.6 |
II |
| Canonical SMILES |
CACTVS |
3.385 |
II |
| Canonical SMILES |
OpenEye OEToolkits |
1.7.6 |
II |
|
IUPAC InChI |
InChI=1S/I2/c1-2 |
IUPAC InChI key |
PNDPGZBMCMUPRI-UHFFFAOYSA-N |
|
wwPDB Information |
Atom count |
2 (2 without Hydrogen) |
Polymer type |
Bound ligand |
Type description |
NON-POLYMER |
Type code |
HETAIN |
Is modified |
No |
Standard parent |
Not Assigned |
Defined at |
2014-09-05 |
Last modified at |
2014-09-26 |
Status |
Released |
Obsoleted |
Not Assigned |
|
Protein Data Bank 
