Synonyms: | Manganese,[29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]-, (SP-4-1)-; Manganese, [phthalocyaninato(2-)]-(6CI,7CI,8CI); 29H,31H-Phthalocyanine, manganese complex;(Phthalocyaninato)manganese; KJB 006; Manganese phthalocyanine; Manganese(II)phthalocyanine; [Phthalocyaninato(2-)]manganese |
Specification: |
The CAS register number of Manganese(II) phthalocyanine is 14325-24-7. It also can be called as Manganese, (29H,31H-phthalocyaninato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, (SP-4-1)- and the systematic name about this chemical is 29H,31H-phthalocyanine, manganese(2+) salt (1:1). The molecular formula about this chemical is C32H16MnN8 and the molecular weight is 567.46. It belongs to the Organometallics. When you are using it, please avoid contact with skin and eyes and do not breathe dust. This chemical is a compound of manganese and phthalocyanine.
Physical properties about Manganese(II) phthalocyanine are: (1)#H bond acceptors: 8; (2)#H bond donors: 2; (3)Polar Surface Area: 108.92Å2; (4)H-Bond Acceptor: 8; (5)Tautomer Count: 3; (6)Exact Mass: 569.103492; (7)MonoIsotopic Mass: 569.103492; (8)Topological Polar Surface Area: 53.4; (9)Heavy Atom Count: 41; (10)Formal Charge: -4; (11)Complexity: 1310; (12)Undefined Atom StereoCenter Count: 2; (13)Undefined Bond StereoCenter Count: 4; (14)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Mn+2].n1c2nc8nc(nc6nc(nc5nc(nc1c3ccccc23)c4ccccc45)c7ccccc67)c9ccccc89
(2)InChI: InChI=1/C32H18N8.Mn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H,(H2,33,34,35,36,37,38,39,40);/q;+2
(3)InChIKey: IWZYXAUFAANREW-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C32H18N8.Mn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H,(H2,33,34,35,36,37,38,39,40);/q;+2
(5)Std. InChIKey: IWZYXAUFAANREW-UHFFFAOYSA-N
|