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(Z)-2-cyano-3-[2,6-di(propan-2-yl)phenyl]imino-1-ethoxy-prop-1-en-1-olate; nickel(2+); 1,3,5-trimethylbenzene-6-ide; triphenylphosphane

(Z)-2-cyano-3-[2,6-di(propan-2-yl)phenyl]imino-1-ethoxy-prop-1-en-1-olate; nickel(2+); 1,3,5-trimethylbenzene-6-ide; triphenylphosphane

Systemtic Name:(Z)-2-cyano-3-[2,6-di(propan-2-yl)phenyl]imino-1-ethoxy-prop-1-en-1-olate; nickel(2+); 1,3,5-trimethylbenzene-6-ide; triphenylphosphane
Openeye Name:nickelous; (Z)-2-cyano-3-(2,6-diisopropylphenyl)imino-1-ethoxy-prop-1-en-1-olate; 1,3,5-trimethylbenzene-6-ide; triphenylphosphane
CAS Name:(Z)-2-cyano-3-[2,6-di(propan-2-yl)phenyl]imino-1-ethoxy-1-propen-1-olate; nickel(2+); 1,3,5-trimethylbenzene-6-ide; triphenylphosphine
IUPAC Name:(Z)-2-cyano-3-[2,6-di(propan-2-yl)phenyl]imino-1-ethoxyprop-1-en-1-olate; nickel(2+); 1,3,5-trimethylbenzene-6-ide; triphenylphosphane
Traditional Name:nickelous; (Z)-2-cyano-3-(2,6-diisopropylphenyl)imino-1-ethoxy-prop-1-en-1-olate; 1,3,5-trimethylbenzene-6-ide; triphenylphosphine
Formula: C63H64N2NiO2P2
MolecularWeight: 1001.835382
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C=NC1=C(C=CC=C1C(C)C)C(C)C)C#N)[O-].CC1=CC(=[C-]C(=C1)C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2]


Isomeric SMILES

CCO/C(=C(/C=NC1=C(C=CC=C1C(C)C)C(C)C)\C#N)/[O-].CC1=CC(=[C-]C(=C1)C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2]


InChI

InChI=1S/C18H24N2O2.2C18H15P.C9H11.Ni/c1-6-22-18(21)14(10-19)11-20-17-15(12(2)3)8-7-9-16(17)13(4)5;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-7-4-8(2)6-9(3)5-7;/h7-9,11-13,21H,6H2,1-5H3;2*1-15H;4-5H,1-3H3;/q;;;-1;+2/p-1/b18-14+,20-11?;;;;


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