[1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-Hexadecafluoro-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]nickel

Catalog Number	ACM128653349
CAS	128653-34-9
Molecular Weight	859.1
Molecular Formula	C32F16N8Ni
Canonical SMILES	C12=C(C(=C(C(=C1F)F)F)F)C3=NC4=NC(=NC5=C6C(=C([N-]5)N=C7C8=C(C(=C(C(=C8F)F)F)F)C(=N7)N=C2[N-]3)C(=C(C(=C6F)F)F)F)C9=C4C(=C(C(=C9F)F)F)F.[Ni+2]
InChI	InChI=1S/C32F16N8.Ni/c33-9-1-2(10(34)18(42)17(9)41)26-49-25(1)53-27-3-4(12(36)20(44)19(43)11(3)35)29(50-27)55-31-7-8(16(40)24(48)23(47)15(7)39)32(52-31)56-30-6-5(28(51-30)54-26)13(37)21(45)22(46)14(6)38;/q-2;+2
InChI Key	URIMSIWGZBACEM-UHFFFAOYSA-N
Purity	98%
Complexity	1460
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	6
Exact Mass	857.934384
Heavy Atom Count	57
Hydrogen Bond Acceptor Count	20
Hydrogen Bond Donor Count	0
Monoisotopic Mass	857.934384
Rotatable Bond Count	0
Topological Polar Surface Area	76.2 Ų