Nickel(II) 2,11,20,29-tetra-butyl-2,3-naphthalocyanine

nickel(2+);8,21,34,47-tetratert-butyl-2,15,28,41,53,55-hexaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1,3,5,7,9,11,13,15,17(26),18,20,22,24,27(55),28,30(39),31,33,35,37,40,42(53),43(52),44,46,48,50-heptacosaene

Also Known As: Nickel(II) 2,11,20,29-tetra-butyl-2,3-naphthalocyanine|Nickel(II)2,11,20,29-tetra-butyl-2,3-naphthalocyanine|Nickel(2+);8,21,34,47-tetratert-butyl-2,15,28,41,53,55-hexaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1,3,5,7,9,11,13,15,17(26),18,20,22,24,27(55),28,30(39),31,33,35,37,40,42(53),43(52),44,46,48,50-heptacosaene|Nickel(II) 2,11,20,29-tetra-tert-butyl-2,3-naphthalocyanine

Molecular Formula	C64H56N8Ni
Molecular Weight	994.39813 g/mol
LogP	15.9277
Topological Polar Surface Area	105.54 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	0
Exact Mass	994.39813
Monoisotopic Mass	994.39813
Heavy Atoms	73
Complexity	4095.7822

Chemical Identifiers

CAS Number	83607-84-5
SMILES	CC(C)(C)C1=CC2=CC3=C(C=C2C=C1)C4=NC5=NC(=NC6=C7C=C8C=C(C=CC8=CC7=C([N-]6)N=C9C1=C(C=C2C=CC(=CC2=C1)C(C)(C)C)C(=N9)N=C3[N-]4)C(C)(C)C)C1=C5C=C2C=C(C=CC2=C1)C(C)(C)C.[Ni+2]