cyclopenta-1,3-diene; (E)-hept-3-ene; nickel(2+)

Systemtic Name: cyclopenta-1,3-diene; (E)-hept-3-ene; nickel(2+) Openeye Name: nickelous; cyclopenta-1,3-diene; (E)-hept-3-ene CAS Name: cyclopenta-1,3-diene; (E)-3-heptene; nickel(2+) IUPAC Name: cyclopenta-1,3-diene; (E)-hept-3-ene; nickel(2+) Traditional Name: nickelous; cyclopenta-1,3-diene; (E)-hept-3-ene Formula: C12H18Ni MolecularWeight: 220.96472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[CH-]C=CCC.C1C=CC=[C-]1.[Ni+2]

Isomeric SMILES

CC[CH-]/C=C/CC.C1C=CC=[C-]1.[Ni+2]

InChI

InChI=1S/C7H13.C5H5.Ni/c1-3-5-7-6-4-2;1-2-4-5-3-1;/h5-7H,3-4H2,1-2H3;1-3H,4H2;/q2*-1;+2/b7-5+;;