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149272-90-2 molecular structure
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3-ethylcyclopenta-2,4-dien-1-ide; chloronickelylium; triphenylphosphane

ChemBase ID: 144982
Molecular Formular: C25H24ClNiP
Molecular Mass: 449.578221
Monoisotopic Mass: 448.06575798
SMILES and InChIs

SMILES:
CCC1=C[CH-]C=C1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.Cl[Ni+]
Canonical SMILES:
c1ccc(cc1)P(c1ccccc1)c1ccccc1.CCC1=C[CH-]C=C1.Cl[Ni+]
InChI:
InChI=1S/C18H15P.C7H9.ClH.Ni/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-7-5-3-4-6-7;;/h1-15H;3-6H,2H2,1H3;1H;/q;-1;;+2/p-1
InChIKey:
QTJKMFINLFTHCC-UHFFFAOYSA-M

Cite this record

CBID:144982 http://www.chembase.cn/molecule-144982.html

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