Manganese(III)meso-tetrakis(4-chlorophenyl)porphine-μ-oxodimer

Catalog Number	ACM154089631
CAS	154089-63-1
Synonyms	Manganese(3+);oxygen(2-);5,10,15,20-tetrakis(4-chlorophenyl)porphyrin-22,24-diide
Molecular Weight	1626.88
Molecular Formula	C88H48Cl8Mn2N8O
Canonical SMILES	C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=C(C=C7)Cl)C8=CC=C(C=C8)Cl)C=C4)C9=CC=C(C=C9)Cl)[N-]3)Cl.C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=C(C=C7)Cl)C8=CC=C(C=C8)Cl)C=C4)C9=CC=C(C=C9)Cl)[N-]3)Cl.[O-2].[Mn+3].[Mn+3]
InChI	InChI=1S/2C44H24Cl4N4.2Mn.O/c2*45-29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(46)12-4-26)37-21-23-39(51-37)44(28-7-15-32(48)16-8-28)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(47)14-6-27;/h2*1-24H;/q2*-2;2*+3;-2
InChI Key	QASVWGGTBVEUDH-UHFFFAOYSA-N
Purity	98%
Complexity	3020
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	1626.016116
Heavy Atom Count	107
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	0
Monoisotopic Mass	1622.022016
Rotatable Bond Count	8
Topological Polar Surface Area	54.4 Ų