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4,4'-di-tert-butyl-2,2'-bipyridine; nickel chloride

4,4'-di-tert-butyl-2,2'-bipyridine; nickel chloride

CAS: 1034901-50-2

Formula: C18H24Cl2N2Ni

SMILES: Cl[Ni]Cl.CC(C)(C)C1=CC(=NC=C1)C1=NC=CC(=C1)C(C)(C)C

IUPAC: 4,4'-di-tert-butyl-2,2'-bipyridine; dichloronickel

InChI: InChI=1S/C18H24N2.2ClH.Ni/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;;;/h7-12H,1-6H3;2*1H;/q;;;+2/p-2

Composition: C (54.32%), H (6.08%), Cl (17.81%), N (7.04%), Ni (14.75%)

Molar Mass: 398

Atom Count: 47

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 396.066996
Formal Charge 0
FSP3 0.44
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey PCWIKFRTCXESOT-UHFFFAOYSA-L
Lipinski's Rule of Five
Molar Refractivity 83.47
Topological Polar Surface Area 25.78
Polarizability 34.18
Ring Count 2
Rotatable Bond Count 3

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