Mn(III) meso-Tetra (N-methyl-4-pyridyl) porphine pentachloride

Catalog Number	ACM125565459-2
CAS	125565-45-9
Structure
Synonyms	Manganese(3+);5,10,15-tris(1-methylpyridin-1-ium-4-yl)-20-(1-methylpyridin-4-ylidene)porphyrin-22-ide;pentachloride
Molecular Weight	909
Molecular Formula	C44H36Cl5MnN8
Canonical SMILES	CN1C=CC(=C2C3=NC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=[N+](C=C7)C)C8=CC=[N+](C=C8)C)C=C4)C9=CC=[N+](C=C9)C)C=C3)C=C1.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Mn+3]
InChI	InChI=1S/C44H36N8.5ClH.Mn/c1-49-21-13-29(14-22-49)41-33-5-7-35(45-33)42(30-15-23-50(2)24-16-30)37-9-11-39(47-37)44(32-19-27-52(4)28-20-32)40-12-10-38(48-40)43(36-8-6-34(41)46-36)31-17-25-51(3)26-18-31;/h5-28H,1-4H3;5*1H;/q+2;+3/p-5
InChI Key	OHZZTXYKLXZFSZ-UHFFFAOYSA-I
Melting Point	>300 °C
Purity	95%
Exact Mass	908.08565
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	0
Monoisotopic Mass	906.0886
Rotatable Bond Count	3
Topological Polar Surface Area	53 Ų