Mol Weight - 204.381
Smiles - CCCCN(CCCC)C([S-])=S.CCCCN(CCCC)C([S-])=S.[Ni+2]
| Property Name | Property Value |
| Mol Name | Nickel Dibutyldithiocarbamate |
| Molweight | 204.381 |
| Monoisotopic Mass | 204.088064 |
| Clogp | 3.4287 |
| Clogs | -3.21 |
| H Acceptors | 1 |
| Total Surface Area | 156.84 |
| Relative Psa | 0.20116 |
| Polar Surface Area | 35.33 |
| Druglikeness | 0.21961 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.75 |
| Molecular Flexibility | 0.76194 |
| Molecular Complexity | 0.47958 |
| Fragments | 3 |
| Non H Atoms | 12 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 6 |
| Sp3 Atoms | 10 |
| Symmetric Atoms | 4 |
| Smiles | CCCCN(CCCC)C([S-])=S.CCCCN(CCCC)C([S-])=S.[Ni+2] |
| InChIKey | InChI=1S/2C9H19NS2.Ni/c2*1-3-5-7-10(9(11)12)8-6-4-2;/h2*3-8H2,1-2H3,(H,11,12);/q;;+2/p-2 |
| InChI | HPOWMHUJHHIQGP-UHFFFAOYSA-L |
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1 — Nickel Dibutyldithiocarbamate | 2 — Nickel Dibutyldithiocarbamate